Carthamus tinctorius

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Description

Synonyms

Common Names

Subtypes (subspecies, varieties, subvarieties, forms)

Germination/Propagation

Distribution

Links to other databases

Genome

Scientific Literature

Phytochemical Profile

Biological Material

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Details Top

Internal ID	UUID643fc8a12668c453244158
Scientific name	Carthamus tinctorius
Authority	L.
First published in	Sp. Pl. : 830 (1753)

Description Top

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Synonyms Top

Scientific name	Authority	First published in
Calcitrapa tinctoria	Roehl.	Deutschl. Fl. , ed. 2, 2: 436 (1812)
Centaurea carthamus	E.H.L.Krause	Deutschl. Fl. Abbild. , ed. 2, 14: 20 (1906)
Carthamus glaber	Burm.f.	Fl. Indica : 23 (1768)
Carduus tinctorius	Ehrh.	Beitr. Naturk. 2: 237 (1788)
Carthamus tinctorius var. albus	Alef.	Landw. Fl.: 181 (1866)
Carthamus tinctorius var. spinosus	Kitam.	Acta Phytotax. Geobot. 26: 140 (1975)
Carthamus tinctorius var. flavus	Alef.	Landw. Fl.: 181 (1866)
Carthamus tinctorius var. croceus	Alef.	Landw. Fl.: 181 (1866)
Carduus tinctorius	(L.) Falk	Beytr. Topogr. Kennt. Russ. Reichs 2: 237. 1786
Calcitrapa tinctoria	Röhl.	Deutschl. Fl. ed. 2, 2: 436 1812

Common names Top

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Language	Common/alternative name
English	safflower
Spanish	alazor
Spanish	cártamo
Spanish	aceite de cartamo
Spanish	azafran romi
Spanish	azafrán romi
Spanish	azafrán romí
Spanish	azafran romin
Spanish	azafrán romin
Spanish	azafrancillo de mexico
Spanish	azafrancillo de méxico
Spanish	cartamo
Spanish	cartamo cultivado
Spanish	cartamo domestico
Spanish	cartamo doméstico
Spanish	hierba papagayo
Spanish	hierba-papagayo
Spanish	simiente de papagayo
Spanish	simiente de papagayos
Amharic	ሱፍ
Arabic	جرجوم
Arabic	عصفر
Arabic	قرطم
Arabic	أحريض
Azerbaijani	boyaq ulaxqanqalı
ban	kesumba
Belarusian	Сафлор фарбавальны
Bulgarian	шафранка
Bengali	কুসুম
Bengali	কুসুম ফুল
Tibetan	གུར་ཀུམ།
Catalan	c. tinctorius
Catalan	càrtam
Catalan	safranó
Catalan	vermelló
ce	Даьтта доккху баӀ
Czech	světlice barvířská
Czech	saflor
Welsh	safflwr
German	falscher safran
German	färbedistel
German	färbersaflor
German	Öldistel
German	safflor
German	saflor
German	färberdistel
Estonian	värvisafloor
Basque	kartamo
Persian	کاجیره
Persian	کاغاله
Persian	گل رنگ
Persian	گلرنگ
Finnish	värisaflori
Finnish	saflori
Finnish	kartamus
Finnish	kartamusuute
French	carthame des teinturiers
Irish	cróch bréige
Galician	azafrán bastardo
Galician	sasafrán bastardo
Galician	cártamo
Hebrew	קורטם הצבעים
Hebrew	שמן חריע
Hebrew	חריע
Hindi	कुसुम
Croatian	Šafranika
Upper Sorbian	barbjerska swětlica
Hungarian	kerti pórsáfrány
Hungarian	olajözön
Hungarian	sáfrányos szeklice
Indonesian	kesumba
io	kartamo
Italian	cartamo o zafferanone
Italian	cartamo
Italian	zafferanone
Japanese	ベニバナ
Japanese	コウカ
Japanese	紅花
Georgian	ალისარჩული
Kazakh	Мақсыр
Kannada	ಕುಸುಬಿ
Korean	잇꽃
Lithuanian	dažinis dygminas
Latvian	krāsu saflors
lzh	紅藍
mad	kasombhâ
Macedonian	шафраника
Malayalam	safflower
Malayalam	ചെണ്ടൂരകം
mni	ꯀꯨꯁꯨꯝꯂꯩ
Marathi	करडई
Malay	kesumba
Burmese	ဆူးပန်း
Norwegian Bokmål	fargetistel
Norwegian Bokmål	saflor
Norwegian Bokmål	safrantistel
Nepali	कुसुम
Dutch	saffloer
Oriya	କୁସୁମ
Punjabi	ਕਸੁੰਭ
pam	kasuba
Polish	kartamus
Polish	krokosz barwierski
Punjab	کسنبھ
Pashto	ځريځه
Portuguese	cártamo
Portuguese	açafrão-bastardo
Romanian	Şofrănel
Romanian	Șofrănel
Russian	Сафлор
Russian	Сафлор красильный
sd	کھنبو
Serbo-Croatian	Šafranika / Шафраника
Serbo-Croatian	Šafranika
Slovak	požlt farbiarsky
Slovenian	navadni rumenik
Slovenian	rumenik
Slovenian	divji žafran
Serbian	Шафраника
su	kasumba
Swedish	färgtistel
Swedish	safflor
Telugu	కుసుమ
Thai	คำฝอย
Thai	safflower
Turkish	aspir
Turkish	boyacı aspiri
Turkish	yalancı safran
Ukrainian	Сафлор красильний
Urdu	گلرنگ
Uzbek	maxsar
Vietnamese	hồng hoa
Chinese	红花
Chinese	红花子
Chinese	草红花
Chinese	刺红花
Chinese	红蓝花
Chinese	川紅花
Chinese	紅花

Subspecies (abbr. subsp./ssp.) Top

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Varieties (abbr. var.) Top

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Subvarieties (abbr. subvar.) Top

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Forms (abbr. f.) Top

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Germination/Propagation Top

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No germination or propagation data was added yet.

Distribution (via POWO/KEW) Top

Legend for the distribution data:

- Doubtful data

- Extinct

- Introduced

- Native

Africa click to expand
- Macaronesia
  - Canary Islands
  - Madeira
- Northeast Tropical Africa
  - Eritrea
  - Ethiopia
  - Sudan
- Northern Africa
  - Algeria
  - Egypt
  - Libya
  - Morocco
  - Tunisia
- South Tropical Africa
  - Mozambique
  - Zimbabwe
- Western Indian Ocean
  - Mauritius

Asia-temperate click to expand
- Arabian Peninsula
  - Gulf States
  - Kuwait
  - Oman
  - Saudi Arabia
  - Yemen
- Caucasus
  - North Caucasus
  - Transcaucasus
- China
  - China North-central
  - China South-central
  - China Southeast
  - Hainan
  - Inner Mongolia
  - Manchuria
  - Qinghai
  - Tibet
  - Xinjiang
- Eastern Asia
  - Japan
  - Korea
- Middle Asia
  - Kazakhstan
  - Tadzhikistan
  - Uzbekistan
- Western Asia
  - Afghanistan
  - East Aegean Islands
  - Iran
  - Iraq
  - Lebanon-Syria
  - Palestine
  - Turkey

Asia-tropical click to expand
- Indian Subcontinent
  - Assam
  - Bangladesh
  - East Himalaya
  - India
  - Nepal
  - Pakistan
  - West Himalaya
- Indo-China
  - Cambodia
  - Laos
  - Myanmar
  - Thailand
  - Vietnam
- Malesia
  - Borneo
  - Jawa
  - Lesser Sunda Islands
  - Malaya
  - Maluku
  - Philippines
  - Sulawesi
  - Sumatera

Australasia click to expand
- Australia
  - New South Wales
  - Northern Territory
  - Queensland
  - South Australia
  - Tasmania
  - Victoria
  - Western Australia
- New Zealand
  - New Zealand North
  - New Zealand South

Europe click to expand
- Eastern Europe
  - Baltic States
  - Central European Russia
  - East European Russia
  - Krym
  - North European Russia
  - Northwest European Russia
  - South European Russia
  - Ukraine
- Middle Europe
  - Austria
  - Belgium
  - Czechoslovakia
  - Germany
  - Hungary
  - Netherlands
  - Poland
  - Switzerland
- Northern Europe
  - Great Britain
  - Ireland
- Southeastern Europe
  - Bulgaria
  - Greece
  - Italy
  - Romania
  - Sicilia
  - Yugoslavia
- Southwestern Europe
  - France
  - Portugal
  - Spain

Northern America click to expand
- Mexico
  - Mexico Central
  - Mexico Gulf
  - Mexico Northeast
  - Mexico Northwest
  - Mexico Southeast
  - Mexico Southwest
- North-central U.S.A.
  - Illinois
  - Iowa
  - Kansas
  - Nebraska
  - North Dakota
- Northeastern U.S.A.
  - Massachusetts
  - New York
  - Ohio
- Northwestern U.S.A.
  - Colorado
  - Idaho
  - Montana
  - Oregon
  - Washington
- South-central U.S.A.
  - New Mexico
- Southwestern U.S.A.
  - Arizona
  - California
  - Utah
- Western Canada
  - Alberta
  - British Columbia

Southern America click to expand
- Caribbean
  - Cuba
- Central America
  - El Salvador
  - Nicaragua
- Southern South America
  - Argentina Northeast
  - Argentina Northwest
  - Argentina South
  - Chile Central
  - Chile North
  - Chile South
  - Paraguay
  - Uruguay
- Western South America
  - Colombia

Links to other databases Top

Suggest others/fix!

Database	ID/link to page
World Flora Online	wfo-0000024004
UNII	5EMV416J82
Flora of Alabama	618
Canadensys	2960
USDA Plants	CATI
Tropicos	2700365
INPN	89239
Flora of Italy	6103
KEW	urn:lsid:ipni.org:names:324467-2
The Plant List	gcc-123195
Open Tree Of Life	1061541
Observations.org	6563
NCBI Taxonomy	4222
NBN Atlas	NBNSYS0000014665
Nature Serve	2.137575
IPNI	324467-2
iNaturalist	76135
GBIF	3138327
Freebase	/m/037wcy
EPPO	CAUTI
EOL	488433
Elurikkus	3487
Calflora (Californian flora)	1664
USDA GRIN	9243
Wikipedia	Safflower
CMAUP	NPO18311

Genomes (via NCBI) Top

Below is displayed the reference genome only!
If you wish to browse all genomes for this plant click here.

Accession	Assembly
Accession	Name	Level	Submitter	Released	Coverage	Size
GCA_001633085.1	Safflower1	Scaffold	University of Georgia	2016-04-27	21.0x	631.27 Mb

Scientific Literature Top

Below are displayed the latest 15 articles published in PMC (PubMed Central®) and other sources (DOI number only)!
If you wish to see all the related articles click here.

Title

Authors

Publication

Released

IDs

A Chinese classical prescription Xuefu Zhuyu decoction in the treatment of coronary heart disease: An overview

Wang X, Xing X, Huang P, Zhang Z, Zhou Z, Liang L, Yao R, Wu X, Yang L

Heliyon

04-Apr-2024

PMCID:	PMC11015425
doi:	10.1016/j.heliyon.2024.e28919
PMID:	38617912

Penicillium polonicum-mediated green synthesis of silver nanoparticles: Unveiling antimicrobial and seed germination advancements

Zhu Y, Hu X, Qiao M, Zhao L, Dong C

Heliyon

04-Apr-2024

PMCID:	PMC11004220
doi:	10.1016/j.heliyon.2024.e28971
PMID:	38601517

The traditional uses, pharmacology, and phytochemistry of Peucedanum praeruptorum Dunn

Wang Q, Sun Q, Huang Q, Qin L, Zhu B

Front Pharmacol

03-Apr-2024

PMCID:	PMC11021687
doi:	10.3389/fphar.2024.1352657
PMID:	38633612

Effects of Moleac 901 after severe spinal cord injury on chronic phase in Wistar rats

Wisnu Wardhana DP, Maliawan S, Bagus Mahadewa TG, Islam AA, Jawi IM, Wiradewi Lestari AA, Kamasan Nyoman Arijana IG, Rosyidi RM, Wiranata S

Heliyon

01-Apr-2024

PMCID:	PMC11004522
doi:	10.1016/j.heliyon.2024.e28522
PMID:	38601579

A novel phage putative depolymerase, Depo16, has specific activity against K1 capsular-type Klebsiella pneumoniae

Zhao R, Jiang S, Ren S, Yang L, Han W, Guo Z, Gu J

Appl Environ Microbiol

29-Mar-2024

PMCID:	PMC11022553
doi:	10.1128/aem.01197-23
PMID:	38551353

Graphic analysis of various sulfur applications on safflower fatty acids profile

Sabaghnia N, Fattahi M, Janmohammadi M, Abbasi A

BioTechnologia (Pozn)

29-Mar-2024

PMCID:	PMC11020149
doi:	10.5114/bta.2024.135640
PMID:	38633892

Gut microbes combined with metabolomics reveal the protective effects of Qijia Rougan decoction against CCl4-induced hepatic fibrosis

Li X, Xu X, Tao S, Su Y, Wen L, Wang D, Liu J, Feng Q

Front Pharmacol

28-Mar-2024

PMCID:	PMC11007057
doi:	10.3389/fphar.2024.1347120
PMID:	38606180

Evidence mapping of traditional Chinese medicine in diabetic peripheral neuropathy treatment

Fu Y, Wang Y, Li Z, Huang K, Gao Y, Xu S, Li Q, Liu X, Zhang G

Front Pharmacol

28-Mar-2024

PMCID:	PMC11006961
doi:	10.3389/fphar.2024.1325607
PMID:	38606175

Herbal Theranostics: Controlled, Targeted Delivery and Imaging of Herbal Molecules

Setia A, Vallamkonda B, Challa RR, Mehata AK, Badgujar P, Muthu MS

Nanotheranostics

25-Mar-2024

PMCID:	PMC10988210
doi:	10.7150/ntno.94987
PMID:	38577318

Comprehensive effect of Naoxintong capsule combined with Western medicine on coronary heart disease after percutaneous coronary intervention: a meta-analysis

Yu L, Huang P, Wang M, Li Z, Cai H, Feng Y, Wu L, Peng W, Zeng J, Chen B

Front Pharmacol

25-Mar-2024

PMCID:	PMC11000174
doi:	10.3389/fphar.2024.1274000
PMID:	38590642

Recent advances in the potential effects of natural products from traditional Chinese medicine against respiratory diseases targeting ferroptosis

Chen T, Ding L, Zhao M, Song S, Hou J, Li X, Li M, Yin K, Li X, Wang Z

Chin Med

22-Mar-2024

PMCID:	PMC10958864
doi:	10.1186/s13020-024-00918-w
PMID:	38519984

Effect of different salinity on seed germination, growth parameters and biochemical contents of pumpkin (Cucurbita pepo L.) seeds cultivars

Irik HA, Bikmaz G

Sci Rep

22-Mar-2024

PMCID:	PMC10960046
doi:	10.1038/s41598-024-55325-w
PMID:	38519514

LC/MS/MS and GC/MS/MS metabolic profiling of Leontodon hispidulus, in vitro and in silico anticancer activity evaluation targeting hexokinase 2 enzyme

Abd-El-Aziz NM, Hifnawy MS, Lotfy RA, Younis IY

Sci Rep

22-Mar-2024

PMCID:	PMC10959984
doi:	10.1038/s41598-024-57288-4
PMID:	38519553

A review of chemotherapeutic drugs-induced arrhythmia and potential intervention with traditional Chinese medicines

Li W, Cheng X, Zhu G, Hu Y, Wang Y, Niu Y, Li H, Aierken A, Li J, Feng L, Liu G

Front Pharmacol

20-Mar-2024

PMCID:	PMC10987752
doi:	10.3389/fphar.2024.1340855
PMID:	38572424

Protective effect of Tao Hong Si Wu Decoction against inflammatory injury caused by intestinal flora disorders in an ischemic stroke mouse model

Zhang L, Xue S, Fei C, Yu C, Li J, Li Y, Wang N, Chu F, Pan L, Duan X, Peng D

BMC Complement Med Ther

18-Mar-2024

PMCID:	PMC10946105
doi:	10.1186/s12906-024-04417-1
PMID:	38500092

Phytochemical Profile Top

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Below are displayed the proven (via scientific papers) natural compounds!
You can also contribute to this by clicking here.

Name	PubChem ID	Canonical SMILES	MW	Found in	Proof
> Alkaloids and derivatives / Macroline alkaloids
(15-Ethylidene-3-methyl-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraen-13-yl)methanol	5087854	Click to see CC=C1CN2C3CC1C(C2CC4=C3N(C5=CC=CC=C45)C)CO	308.40	unknown	https://doi.org/10.1271/BBB.64.1588
> Benzenoids / Anthracenes / Anthraquinones / Hydroxyanthraquinones
1,3-Dimethoxy-2-hydroxy-9,10-anthraquinone	15118825	Click to see COC1=C(C(=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)OC)O	284.26	unknown	https://doi.org/10.1021/OL902971W
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives
4-Hydroxybenzoic acid	135	Click to see C1=CC(=CC=C1C(=O)O)O	138.12	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Gallic acids
Gallic Acid	370	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)O	170.12	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives
Vanillic Acid	8468	Click to see COC1=C(C=CC(=C1)C(=O)O)O	168.15	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Salicylic acid and derivatives / Salicylic acids
Ginkgolic acid	5281858	Click to see CCCCCCC=CCCCCCCCC1=C(C(=CC=C1)O)C(=O)O	346.50	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / p-Hydroxybenzoic acid esters / p-Hydroxybenzoic acid alkyl esters
Methyl 3-[(2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methyl]-4,5-dihydroxybenzoate	74052156	Click to see CC1=CCC2C(CCCC2(C1CC3=C(C(=CC(=C3)C(=O)OC)O)O)C)(C)C	372.50	unknown	https://doi.org/10.1248/CPB.41.1796
> Benzenoids / Benzene and substituted derivatives / Phenylacetaldehydes
1-deuterio-2-phenyl(113C)ethanone	10441698	Click to see C1=CC=C(C=C1)CC=O	122.15	unknown	via CMAUP database
Phenylacetaldehyde	998	Click to see C1=CC=C(C=C1)CC=O	120.15	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Styrenes
1,2-Bis(ethenyl)benzene;1,3-bis(ethenyl)benzene;1,4-bis(ethenyl)benzene	24832064	Click to see C=CC1=CC=C(C=C1)C=C.C=CC1=CC(=CC=C1)C=C.C=CC1=CC=CC=C1C=C	390.60	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Toluenes
4-Allyltoluene	76851	Click to see CC1=CC=C(C=C1)CC=C	132.20	unknown	via CMAUP database
> Benzenoids / Naphthalenes
7,9,10,17-Tetrahydroxypentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(20),2,7,9,11,13,16,18-octaene-4,15-dione	162877391	Click to see C1CC(=O)C2=C3C4=C5C(=C3C(=C(C2=C1O)O)O)C=CC(=O)C5=C(C=C4)O	348.30	unknown	https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1271/BBB.59.1588 https://doi.org/10.1246/CL.1994.2343 https://doi.org/10.1016/S0015-3796(11)80143-5
> Benzenoids / Phenol ethers / Anisoles
beta-Asarone	5281758	Click to see CC=CC1=CC(=C(C=C1OC)OC)OC	208.25	unknown	via CMAUP database
> Benzenoids / Phenols / Methoxyphenols
4,4''-bis(N-feruloyl)serotonin	10484893	Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CNC3=C2C(=C(C=C3)O)C4=C(C=CC5=C4C(=CN5)CCNC(=O)C=CC6=CC(=C(C=C6)O)OC)O)O	702.70	unknown	https://doi.org/10.1248/CPB.44.874
N-[2-[5-hydroxy-4-[5-hydroxy-3-[2-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoylamino]ethyl]-1H-indol-4-yl]-1H-indol-3-yl]ethyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide	85156029	Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CNC3=C2C(=C(C=C3)O)C4=C(C=CC5=C4C(=CN5)CCNC(=O)C=CC6=CC(=C(C=C6)O)OC)O)O	702.70	unknown	https://doi.org/10.1248/CPB.44.874
N-[2-[5-hydroxy-4-[5-hydroxy-3-[2-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoylamino]ethyl]-1H-indol-4-yl]-1H-indol-3-yl]ethyl]-3-(4-hydroxyphenyl)prop-2-enamide	85155908	Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CNC3=C2C(=C(C=C3)O)C4=C(C=CC5=C4C(=CN5)CCNC(=O)C=CC6=CC=C(C=C6)O)O)O	672.70	unknown	https://doi.org/10.1248/CPB.44.874
> Hydrocarbons / Saturated hydrocarbons / Alkanes
Nonacosane	12409	Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCC	408.80	unknown	via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Enynes
(3E,5E,11E)-trideca-1,3,5,11-tetraen-7,9-diyne	5352698	Click to see CC=CC#CC#CC=CC=CC=C	168.23	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X https://doi.org/10.1080/00021369.1975.10861728
(3E,5Z)-1,3,5-Tridecatriene-7,9,11-triyne	5322029	Click to see CC#CC#CC#CC=CC=CC=C	166.22	unknown	https://doi.org/10.1080/00021369.1975.10861728
(E,Z)-1,3,5-Tridecatriene-7,9,11-triyne	5352700	Click to see CC#CC#CC#CC=CC=CC=C	166.22	unknown	via CMAUP database
(E)-1,11-Tridecadiene-3,5,7,9-tetrayne	5352703	Click to see CC=CC#CC#CC#CC#CC=C	164.20	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X
(Z,Z)-1,3,11-Tridecatriene-5,7,9-triyne	5352708	Click to see CC=CC#CC#CC#CC=CC=C	166.22	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X
(Z)-1,3-Tridecadiene-5,7,9,11-tetrayne	5352699	Click to see CC#CC#CC#CC#CC=CC=C	164.20	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X https://doi.org/10.1080/00021369.1975.10861728
1-Tridecene-3,5,7,9,11-pentayne	441552	Click to see CC#CC#CC#CC#CC#CC=C	162.19	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X https://doi.org/10.1080/00021369.1975.10861728
1,11-Tridecadien-3,5,7,9-tetrayne	528754	Click to see CC=CC#CC#CC#CC#CC=C	164.20	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X https://doi.org/10.1080/00021369.1975.10861728 https://doi.org/10.1002/CBER.19660991107
1,11-Tridecadiene-3,5,7,9-tetrayne	5322026	Click to see CC=CC#CC#CC#CC#CC=C	164.20	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X https://doi.org/10.1080/00021369.1975.10861728
1,3,11-Tridecatriene-5,7,9-triyne	180274	Click to see CC=CC#CC#CC#CC=CC=C	166.22	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X https://doi.org/10.1002/CBER.19660991107 https://doi.org/10.1080/00021369.1975.10861728 https://doi.org/10.1080/00021369.1976.10862338
1,3,11-Tridecatriene-5,7,9-triyne, (Z,E)-	5352706	Click to see CC=CC#CC#CC#CC=CC=C	166.22	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X https://doi.org/10.1080/00021369.1976.10862338
1,3,5,11-Tridecatetraene-7,9-diyne	150169	Click to see CC=CC#CC#CC=CC=CC=C	168.23	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X https://doi.org/10.1080/00021369.1975.10861728
1,3(E),5(Z),11(E)-Tridecatetraen-7,9-diyne	5352702	Click to see CC=CC#CC#CC=CC=CC=C	168.23	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X
7-Chloro-2-(4-chlorophenyl)-3-methylquinoline	5352707	Click to see CC=CC#CC#CC=CC=CC=C	168.23	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X
trans,trans-1,3,11-Tridecatriene-5,7,9-triyne	5322028	Click to see CC=CC#CC#CC#CC=CC=C	166.22	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X https://doi.org/10.1002/CBER.19660991107 https://doi.org/10.1080/00021369.1975.10861728 https://doi.org/10.1080/00021369.1976.10862338
Tridec-1,3-diene-5,7,9,11-tetrayne	528755	Click to see CC#CC#CC#CC#CC=CC=C	164.20	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X https://doi.org/10.1080/00021369.1975.10861728
Trideca-1,3,5-trien-7,9,11-triyne	528756	Click to see CC#CC#CC#CC=CC=CC=C	166.22	unknown	https://doi.org/10.1080/00021369.1975.10861728
> Hydrocarbons / Unsaturated hydrocarbons / Olefins / Acyclic olefins / Alkatetraenes
1,8,11,14-Heptadecatetraene, (Z,Z,Z)-	5352710	Click to see CCC=CCC=CCC=CCCCCCC=C	232.40	unknown	https://doi.org/10.1016/0031-9422(75)83135-9
Heptadeca-1,8,11,14-tetraene	82660	Click to see CCC=CCC=CCC=CCCCCCC=C	232.40	unknown	https://doi.org/10.1016/0031-9422(75)83135-9
> Hydrocarbons / Unsaturated hydrocarbons / Unsaturated aliphatic hydrocarbons
1-Heptadecene	23217	Click to see CCCCCCCCCCCCCCCC=C	238.50	unknown	via CMAUP database
1-Hexadecene	12395	Click to see CCCCCCCCCCCCCCC=C	224.42	unknown	via CMAUP database
1-Undecene	13190	Click to see CCCCCCCCCC=C	154.29	unknown	https://doi.org/10.1039/C39910001731
> Lignans, neolignans and related compounds / Furanoid lignans / Tetrahydrofuran lignans / 9,9-epoxylignans / Dibenzylbutyrolactone lignans
(+)-Matairesinol	11451194	Click to see COC1=C(C=CC(=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)O)OC)O	358.40	unknown	via CMAUP database
Arctigenin	64981	Click to see COC1=C(C=C(C=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)O)OC)OC	372.40	unknown	https://doi.org/10.1080/00021369.1980.10864416 https://doi.org/10.1271/BBB1961.44.2951
Matairesinol	119205	Click to see COC1=C(C=CC(=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)O)OC)O	358.40	unknown	https://doi.org/10.1271/BBB1961.44.2951 https://doi.org/10.1080/00021369.1980.10864416
> Lignans, neolignans and related compounds / Lignan glycosides
(-)-Tracheloside	53462879	Click to see COC1=C(C=C(C=C1)CC2COC(=O)C2(CC3=CC(=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)OC)O)OC	550.60	unknown	https://doi.org/10.1271/BBB.60290 https://doi.org/10.1271/BBB1961.44.2951 https://doi.org/10.1021/NP200780M
(3S,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-3-[[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one	162859853	Click to see COC1=C(C=C(C=C1)CC2COC(=O)C2(CC3=CC(=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)OC)O)OC	550.60	unknown	https://doi.org/10.1271/BBB1961.44.2951
(3S,4S)-4-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-3-[[3-methoxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one	162859850	Click to see COC1=C(C=C(C=C1)CC2COC(=O)C2(CC3=CC(=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)OC)O)OC	550.60	unknown	https://doi.org/10.1271/BBB.60290
3-[(4-Hydroxy-3-methoxyphenyl)methyl]-4-[[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one	74105540	Click to see COC1=C(C=CC(=C1)CC2C(COC2=O)CC3=CC(=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)OC)O	520.50	unknown	https://doi.org/10.1271/BBB1961.44.2951
Styraxlignolide D	11179934	Click to see COC1=C(C=CC(=C1)CC2C(COC2=O)CC3=CC(=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)OC)O	520.50	unknown	https://doi.org/10.1271/BBB1961.44.2951
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Branched fatty acids / Methyl-branched fatty acids
Isovaleric acid	10430	Click to see CC(C)CC(=O)O	102.13	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
(2E,4E,6E)-icosa-2,4,6-trienoic acid	6506063	Click to see CCCCCCCCCCCCCC=CC=CC=CC(=O)O	306.50	unknown	via CMAUP database
(Z)-9,10-dideuteriooctadec-9-enoic acid	13011408	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	284.50	unknown	via CMAUP database
11,14,17-Eicosatrienoic acid	5312529	Click to see CCC=CCC=CCC=CCCCCCCCCCC(=O)O	306.50	unknown	via CMAUP database
9-Hexadecenoic acid	5282745	Click to see CCCCCCC=CCCCCCCCC(=O)O	254.41	unknown	via CMAUP database
Arachidate	5461017	Click to see CCCCCCCCCCCCCCCCCCCC(=O)[O-]	311.50	unknown	via CMAUP database
Arachidic Acid	10467	Click to see CCCCCCCCCCCCCCCCCCCC(=O)O	312.50	unknown	via CMAUP database
Eicosadienoic acid	6439848	Click to see CCCCCC=CCC=CCCCCCCCCCC(=O)O	308.50	unknown	via CMAUP database
Elaidic Acid	637517	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	282.50	unknown	via CMAUP database
Heptadecanoic acid	10465	Click to see CCCCCCCCCCCCCCCCC(=O)O	270.50	unknown	via CMAUP database
Icosa-2,4,6-trienoic acid	157667	Click to see CCCCCCCCCCCCCC=CC=CC=CC(=O)O	306.50	unknown	via CMAUP database
Myristic Acid	11005	Click to see CCCCCCCCCCCCCC(=O)O	228.37	unknown	via CMAUP database
Oleate	5460221	Click to see CCCCCCCCC=CCCCCCCCC(=O)[O-]	281.50	unknown	via CMAUP database
Oleic Acid	445639	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	282.50	unknown	https://doi.org/10.1016/0005-2760(83)90001-2
Palmitic Acid	985	Click to see CCCCCCCCCCCCCCCC(=O)O	256.42	unknown	https://doi.org/10.1007/BF00581591
Palmitoleic Acid	445638	Click to see CCCCCCC=CCCCCCCCC(=O)O	254.41	unknown	via CMAUP database
Pentadecanoic acid	13849	Click to see CCCCCCCCCCCCCCC(=O)O	242.40	unknown	via CMAUP database
Stearate	3033836	Click to see CCCCCCCCCCCCCCCCCC(=O)[O-]	283.50	unknown	via CMAUP database
Stearic Acid	5281	Click to see CCCCCCCCCCCCCCCCCC(=O)O	284.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids
Lauric Acid	3893	Click to see CCCCCCCCCCCC(=O)O	200.32	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Very long-chain fatty acids
Behenic Acid	8215	Click to see CCCCCCCCCCCCCCCCCCCCCC(=O)O	340.60	unknown	via CMAUP database
Doconexent	445580	Click to see CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)O	328.50	unknown	via CMAUP database
Nervonic Acid	5281120	Click to see CCCCCCCCC=CCCCCCCCCCCCCCC(=O)O	366.60	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides
(2R,3R,4S,5S,6R)-2-[(10R)-10,14-dihydroxytetradec-2-en-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	162868027	Click to see C(CCO)CC(CCC#CC#CC=CCOC1C(C(C(C(O1)CO)O)O)O)O	398.40	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(2R,3R,4S,5S,6R)-2-[(12R)-12,13-dihydroxytrideca-2,8,10-trien-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	163097776	Click to see C(C=CC#CC#CC=CC=CC(CO)O)OC1C(C(C(C(O1)CO)O)O)O	380.40	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(2R,3R,4S,5S,6R)-2-[(12R)-12,14-dihydroxytetradeca-2,8-dien-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	162868031	Click to see C(CC(CCO)O)C=CC#CC#CC=CCOC1C(C(C(C(O1)CO)O)O)O	396.40	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(2R,3R,4S,5S,6R)-2-[(2E,8E,10E,12R)-12,13-dihydroxytrideca-2,8,10-trien-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	56965054	Click to see C(C=CC#CC#CC=CC=CC(CO)O)OC1C(C(C(C(O1)CO)O)O)O	380.40	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(2R,3R,4S,5S,6R)-2-[(2E,8E,12R)-12,14-dihydroxytetradeca-2,8-dien-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	56965151	Click to see C(CC(CCO)O)C=CC#CC#CC=CCOC1C(C(C(C(O1)CO)O)O)O	396.40	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(2R,3R,4S,5S,6R)-2-[(2E,8Z,12R)-12,14-dihydroxytetradeca-2,8-dien-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	56965154	Click to see C(CC(CCO)O)C=CC#CC#CC=CCOC1C(C(C(C(O1)CO)O)O)O	396.40	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(2R,3R,4S,5S,6R)-2-[(2E,8Z)-deca-2,8-dien-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	56965053	Click to see CC=CC#CC#CC=CCOC1C(C(C(C(O1)CO)O)O)O	308.33	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(2R,3R,4S,5S,6R)-2-[(2Z,8E,12R)-12,14-dihydroxytetradeca-2,8-dien-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	56965153	Click to see C(CC(CCO)O)C=CC#CC#CC=CCOC1C(C(C(C(O1)CO)O)O)O	396.40	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(2R,3R,4S,5S,6R)-2-[(2Z,8Z,12R)-12,14-dihydroxytetradeca-2,8-dien-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	56965152	Click to see C(CC(CCO)O)C=CC#CC#CC=CCOC1C(C(C(C(O1)CO)O)O)O	396.40	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(2R,3R,4S,5S,6R)-2-[(E,10R)-10,14-dihydroxytetradec-2-en-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	56965055	Click to see C(CCO)CC(CCC#CC#CC=CCOC1C(C(C(C(O1)CO)O)O)O)O	398.40	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(2R,3R,4S,5S,6R)-2-deca-2,8-dien-4,6-diynoxy-6-(hydroxymethyl)oxane-3,4,5-triol	162868037	Click to see CC=CC#CC#CC=CCOC1C(C(C(C(O1)CO)O)O)O	308.33	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(4aR,6R,7R,8S,8aS)-6-[(Z)-dec-8-en-4,6-diynoxy]-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-7,8-diol	162872983	Click to see CC=CC#CC#CCCCOC1C(C(C2C(O1)COC(O2)(C)C)O)O	350.40	unknown	https://doi.org/10.1248/CPB.54.1455
2-Dec-8-en-4,6-diynoxy-6-(hydroxymethyl)oxane-3,4,5-triol	73802885	Click to see CC=CC#CC#CCCCOC1C(C(C(C(O1)CO)O)O)O	310.34	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
Bidenoside C	70695725	Click to see CC=CC#CC#CCCCOC1C(C(C(C(O1)CO)O)O)O	310.34	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
Bidenoside C	21577069	Click to see CC=CC#CC#CCCCOC1C(C(C(C(O1)CO)O)O)O	310.34	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
Roseoside	9930064	Click to see CC1=CC(=O)CC(C1(C=CC(C)OC2C(C(C(C(O2)CO)O)O)O)O)(C)C	386.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters
(Z)-8-Decene-4,6-diyn-1-yl 3-methylbutanoate	5352705	Click to see CC=CC#CC#CCCCOC(=O)CC(C)C	232.32	unknown	https://doi.org/10.1002/CBER.19701030920
[(3S,4E,6E,12E)-3-acetyloxytetradeca-4,6,12-trien-8,10-diynyl] acetate	92974046	Click to see CC=CC#CC#CC=CC=CC(CCOC(=O)C)OC(=O)C	300.30	unknown	https://doi.org/10.1002/CBER.19660991107
3-Acetyloxytetradeca-4,6,12-trien-8,10-diynyl acetate	85040203	Click to see CC=CC#CC#CC=CC=CC(CCOC(=O)C)OC(=O)C	300.30	unknown	https://doi.org/10.1002/CBER.19660991107
Dec-8-en-4,6-diynyl 3-methylbutanoate	528758	Click to see CC=CC#CC#CCCCOC(=O)CC(C)C	232.32	unknown	https://doi.org/10.1002/CBER.19701030920
Octadeca-9,12-dien-1-yl acetate	44134803	Click to see CCCCCC=CCC=CCCCCCCCCOC(=O)C	308.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
(6R,8S)-6,8-Heptacosanediol	10387003	Click to see CCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	412.70	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
(6R,8S)-nonacosane-6,8-diol	10478459	Click to see CCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	440.80	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
(6R,8S)-octacosane-6,8-diol	11743234	Click to see CCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	426.80	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
(6R,8S)-triacontane-6,8-diol	10027010	Click to see CCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	454.80	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
(6R,8S)-6,8-Tetratriacontanediol	85148698	Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	510.90	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
erythro-6,8-Dotriacontanediol	101664409	Click to see CCCCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	482.90	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
erythro-6,8-Octacosanediol	73082401	Click to see CCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	426.80	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
Hentriacontane-6,8-diol	101664408	Click to see CCCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	468.80	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
Heptacosane-6,8-diol	10387002	Click to see CCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	412.70	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
Nonacosane-6,8-diol	130335	Click to see CCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	440.80	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
Pentatriacontane-6,8-diol	73087500	Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	524.90	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
rel-(6R,8S)-6,8-Dotriacontanediol	10073998	Click to see CCCCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	482.90	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
rel-(6R,8S)-6,8-Hentriacontanediol	10073357	Click to see CCCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	468.80	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
rel-(6R,8S)-6,8-Pentatriacontanediol	11756584	Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	524.90	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
rel-(6R,8S)-6,8-Tetratriacontanediol	10459029	Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	510.90	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
rel-(6R,8S)-6,8-Tritriacontanediol	10051545	Click to see CCCCCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	496.90	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
Triacontane-6,8-diol	85096450	Click to see CCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	454.80	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
Tritriacontane-6,8-diol	85104056	Click to see CCCCCCCCCCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	496.90	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols
(2S,3E,11E)-trideca-3,11-dien-5,7,9-triyne-1,2-diol	5281155	Click to see CC=CC#CC#CC#CC=CC(CO)O	200.23	unknown	https://doi.org/10.1002/CBER.19660991107 https://doi.org/10.1016/0031-9422(71)85027-6 https://doi.org/10.1002/CBER.19701030920 https://doi.org/10.1094/PHYTO-62-471
(3E,11Z)-trideca-3,11-dien-5,7,9-triyne-1,2-diol	131751993	Click to see CC=CC#CC#CC#CC=CC(CO)O	200.23	unknown	https://doi.org/10.1094/PHYTO-62-471
(3R,6E,12E)-tetradeca-6,12-dien-8,10-diyne-1,3,14-triol	162919827	Click to see C(CC(CCO)O)C=CC#CC#CC=CCO	234.29	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
(6R,8S)-henicosane-6,8-diol	10471738	Click to see CCCCCCCCCCCCCC(CC(CCCCC)O)O	328.60	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
(6R,8S)-pentacosane-6,8-diol	10022937	Click to see CCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	384.70	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
(6R,8S)-tricosane-6,8-diol	11725842	Click to see CCCCCCCCCCCCCCCC(CC(CCCCC)O)O	356.60	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
CID 3036540	3036540	Click to see CC=CC#CC#CC#CC=CC(CO)O	200.23	unknown	https://doi.org/10.1016/0031-9422(71)85027-6
Dehydrosafynol	5281147	Click to see CC=CC#CC#CC#CC#CC(CO)O	198.22	unknown	https://doi.org/10.1094/PHYTO-62-471
erythro-6,8-Heneicosanediol	85152479	Click to see CCCCCCCCCCCCCC(CC(CCCCC)O)O	328.60	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
erythro-6,8-Pentacosanediol	85095318	Click to see CCCCCCCCCCCCCCCCCC(CC(CCCCC)O)O	384.70	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
Safynol	6442707	Click to see CC=CC#CC#CC#CC=CC(CO)O	200.23	unknown	via CMAUP database
Tetradeca-6,12-dien-8,10-diyne-1,3,14-triol	162919826	Click to see C(CC(CCO)O)C=CC#CC#CC=CCO	234.29	unknown	https://doi.org/10.1016/J.CARRES.2011.06.015
Tricosane-6,8-diol	73074749	Click to see CCCCCCCCCCCCCCCC(CC(CCCCC)O)O	356.60	unknown	https://doi.org/10.1016/S0031-9422(00)97021-3
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
Linoleic Acid	5280450	Click to see CCCCCC=CCC=CCCCCCCCC(=O)O	280.40	unknown	https://doi.org/10.1016/0005-2760(83)90001-2
Linolenic Acid	5280934	Click to see CCC=CCC=CCC=CCCCCCCCC(=O)O	278.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Glycerolipids / Triradylcglycerols / Triacylglycerols
Tristearin	11146	Click to see CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC	891.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
((1S,4aS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthren-1-yl)methanamine	15632212	Click to see CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CN)C	285.50	unknown	via CMAUP database
Dehydroabietylamine	62034	Click to see CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CN)C	285.50	unknown	via CMAUP database
Dihydroabietylamine	106831	Click to see CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CN)C	285.50	unknown	via CMAUP database
Leelamine	118215	Click to see CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CN)C	285.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids
(7S,11S)-3,7,11,15-Tetramethyl-2-hexadecene-1-ol	40467768	Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C	296.50	unknown	https://doi.org/10.1007/BF00581591
(E)-(7R,11R)-3,7,11,15-tetramethylhexadec-2-ene-1-ol	145386	Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C	296.50	unknown	https://doi.org/10.1007/BF00581591
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Cembrane diterpenoids
(1E,5E,12R)-1,5,9-trimethyl-12-propan-2-ylcyclotetradeca-1,5,9-triene	45115200	Click to see CC1=CCCC(=CCC(CCC(=CCC1)C)C(C)C)C	274.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Grayanoids
[(1S,3R,4R,6R,8S,9S,10R,11R,14R,15R,17R)-3,4,10,15-tetrahydroxy-5,5,10,15-tetramethyl-7-oxapentacyclo[12.2.1.01,11.04,9.06,8]heptadecan-17-yl] propanoate	163072513	Click to see CCC(=O)OC1C2CCC3C1(CC(C4(C(C3(C)O)C5C(C4(C)C)O5)O)O)CC2(C)O	424.50	unknown	https://doi.org/10.1248/CPB.41.1796
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Taxanes and derivatives
[(1S,2S,3R,4S,7R,9S,10S,11S,12R,15S)-4,9,11,12,15-pentaacetyloxy-1-hydroxy-10,14,17,17-tetramethyl-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate	5321426	Click to see CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C	714.80	unknown	https://doi.org/10.1271/BBB.64.1588
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Tigliane and ingenane diterpenoids
[(1R,2R,6S,10R,11R,13S,14R,15R)-13-acetyloxy-8-formyl-1-hydroxy-4,12,12,15-tetramethyl-5-oxo-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] 2-(methylamino)benzoate	162901456	Click to see CC1C(C2(C(C2(C)C)C3C1(C4C=C(C(=O)C4CC(=C3)C=O)C)O)OC(=O)C)OC(=O)C5=CC=CC=C5NC	521.60	unknown	https://doi.org/10.1016/S0031-9422(96)00343-3
[(1S,4S,5R,6R,9S,14R)-4,5,6-trihydroxy-3,11,11,14-tetramethyl-15-oxo-7-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl]methyl hexadecanoate	5318035	Click to see CCCCCCCCCCCCCCCC(=O)OCC1=CC2C3C(C3(C)C)CC(C4(C2=O)C=C(C(C4(C1O)O)O)C)C	586.80	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Villanovane, atisane, trachylobane or helvifulvane diterpenoids / Atisane diterpenoids / Hetisine-type diterpenoid alkaloids
[(1R,2S,3S,5R,8R,9S,11S,13R,14S,16S,17R,18S)-2-acetyloxy-13,18-dihydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.01,8.05,17.07,16.09,14.014,18]nonadecan-3-yl] benzoate	163025038	Click to see CC(=O)OC1C(CC2(CN3C4C2C15C3C6CC7CC5(C6(C4)C(C7=C)O)O)C)OC(=O)C8=CC=CC=C8	491.60	unknown	https://doi.org/10.1021/OL902971W
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
Carvacrol	10364	Click to see CC1=C(C=C(C=C1)C(C)C)O	150.22	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Triquinane sesquiterpenoids / Linear triquinanes
3b,6-Dihydroxy-3a,5,5-trimethyl-3-methylidene-4,6-dihydrocyclopenta[a]pentalen-2-one	78201177	Click to see CC1(CC2(C(=CC3=CC(=O)C(=C)C32C)C1O)O)C	246.30	unknown	https://doi.org/10.1248/CPB.41.1796
> Lipids and lipid-like molecules / Prenol lipids / Sesterterpenoids / Scalarane sesterterpenoids
Taraxerol	92097	Click to see CC1(CCC2(CC=C3C4(CCC5C(C(CCC5(C4CCC3(C2C1)C)C)O)(C)C)C)C)C	426.70	unknown	https://doi.org/10.1016/S0031-9422(96)00343-3
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
2,2-bis[2,5-dihydroxy-3-[(E)-1-hydroxy-3-(4-hydroxyphenyl)prop-2-enylidene]-4,6-dioxo-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexen-1-yl]acetic acid	101928647	Click to see C1=CC(=CC=C1C=CC(=C2C(=C(C(=O)C(C2=O)(C3C(C(C(C(O3)CO)O)O)O)O)C(C4=C(C(=C(C=CC5=CC=C(C=C5)O)O)C(=O)C(C4=O)(C6C(C(C(C(O6)CO)O)O)O)O)O)C(=O)O)O)O)O	956.80	unknown	via CMAUP database
SafflominB	101241647	Click to see C1=CC(=CC=C1C=CC(=C2C(=C(C(=O)C(C2=O)(C3C(C(C(C(O3)CO)O)O)O)O)C(C4=C(C(=C(C=CC5=CC=C(C=C5)O)O)C(=O)C(C4=O)(C6C(C(C(C(O6)CO)O)O)O)O)O)C(C(C(C(CO)O)O)O)O)O)O)O	1062.90	unknown	via CMAUP database
Safflor Yellow B	131751452	Click to see C1=CC(=CC=C1C=CC(=C2C(=C(C(=O)C(C2=O)(C3C(C(C(C(O3)CO)O)O)O)O)C(C4=C(C(=C(C=CC5=CC=C(C=C5)O)O)C(=O)C(C4=O)(C6C(C(C(C(O6)CO)O)O)O)O)O)C(C(C(C(CO)O)O)O)O)O)O)O	1062.90	unknown	https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1248/CPB.41.1796 https://doi.org/10.1021/NP50091A006
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Iridoid O-glycosides
(2R,3R,4R,5R,6S)-2-[[(1S,4aS,5R,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-5-yl]oxy]-6-methyloxane-3,4,5-triol	162971615	Click to see CC1C(C(C(C(O1)OC2C=C(C3C2C=COC3OC4C(C(C(C(O4)CO)O)O)O)CO)O)O)O	492.50	unknown	https://doi.org/10.1271/BBB.64.1588
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones
(4S,5'S,7R,8R,8aS)-5'-(furan-3-yl)-4-hydroxy-4-(hydroxymethyl)-7-methylspiro[1,2,3,6,7,8a-hexahydronaphthalene-8,3'-oxolane]-2'-one	54598291	Click to see CC1CC=C2C(C13CC(OC3=O)C4=COC=C4)CCCC2(CO)O	332.40	unknown	https://doi.org/10.1248/CPB.40.3355
2-(2-methyl-6-oxohept-2-enyl)-4-(4-methylpent-3-enyl)-2H-furan-5-one	75597491	Click to see CC(=CCCC1=CC(OC1=O)CC(=CCCC(=O)C)C)C	290.40	unknown	https://doi.org/10.1271/BBB.64.1588
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bR)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid	7048528	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C	456.70	unknown	via CMAUP database
3,7,7,11,16,20,20-Heptamethylpentacyclo[13.8.0.03,12.06,11.016,21]tricosane-1,8,19-triol	78079764	Click to see CC1(C2CCC3(CC4(CCC5C(C(CCC5(C4CCC3C2(CCC1O)C)C)O)(C)C)O)C)C	460.70	unknown	https://doi.org/10.1021/OL902971W
alpha-Onocerin	11453544	Click to see CC1(C2CCC(=C)C(C2(CCC1O)C)CCC3C(=C)CCC4C3(CCC(C4(C)C)O)C)C	442.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives / Hydroxy bile acids, alcohols and derivatives / Monohydroxy bile acids, alcohols and derivatives
(3S,6R)-6-[(8R,9S,10S,13R,14S,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2,3-dimethylheptan-1-ol	66699452	Click to see CC(CCC(C)C(C)CO)C1CCC2C1(CCC3C2CCC4C3(CCCC4)C)C	402.70	unknown	https://doi.org/10.1002/PTR.2650080603
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cholestane steroids / Cholesterols and derivatives
Cholesterol	5997	Click to see CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	386.70	unknown	https://doi.org/10.1002/PTR.2650080603
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives
Cycloartenol	92110	Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C	426.70	unknown	https://doi.org/10.1016/S0031-9422(96)00343-3
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
(3S,10S,13R,17R)-17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	5317423	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C	400.70	unknown	https://doi.org/10.1002/PTR.2650080603
(3S,8S,9S,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	134766514	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	400.70	unknown	https://doi.org/10.1002/PTR.2650080603
22,23-Dihydrobrassicasterol	5283637	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	400.70	unknown	https://doi.org/10.1002/PTR.2650080603
24-Methylene pollinastanol	118987255	Click to see CC(C)C(=C)CCC(C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5)O)C)C	412.70	unknown	https://doi.org/10.1002/PTR.2650080603
5-Cholestene-3-ol, 24-methyl-	312822	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	400.70	unknown	https://doi.org/10.1002/PTR.2650080603
Ergostanol	5283641	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C	402.70	unknown	https://doi.org/10.1002/PTR.2650080603
Fungisterol	5283646	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C	400.70	unknown	https://doi.org/10.1002/PTR.2650080603
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 6-hydroxysteroids
2-(methylamino)ethyl 2-(8-formyl-7,10-dihydroxy-1,4b,8-trimethyl-3,4,4a,5,6,7,8a,9,10,10a-decahydro-1H-phenanthren-2-ylidene)acetate	427696	Click to see CC1C2C(CCC1=CC(=O)OCCNC)C3(CCC(C(C3CC2O)(C)C=O)O)C	407.50	unknown	https://doi.org/10.1021/OL902971W
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides
[(3S,8R,9S,10R,12R,13S,14S,17S)-17-acetyl-14,17-dihydroxy-3-[(2R,4S,5R,6R)-5-[(2S,4R,5S,6S)-5-[(2S,4R,5S,6S)-5-[(2S,4S,5R,6R)-5-[(2S,4S,5S,6R)-4-hydroxy-5-[(2S,4R,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-10,13-dimethyl-2,3,4,7,8,9,11,12,15,16-decahydro-1H-cyclopenta[a]phenanthren-12-yl] acetate	163191889	Click to see CC1C(C(CC(O1)OC2C(OC(CC2O)OC3C(OC(CC3OC)OC4C(OC(CC4OC)OC5C(OC(CC5OC)OC6C(OC(CC6OC)OC7CCC8(C9CC(C1(C(C9CC=C8C7)(CCC1(C(=O)C)O)O)C)OC(=O)C)C)C)C)C)C)C)OC)O	1257.50	unknown	https://doi.org/10.1271/BBB.64.1588
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
(-)-beta-Sitosterol	6432744	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	via CMAUP database
(24E)-24-N-Propylidenecholesterol	5281328	Click to see CC=C(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	https://doi.org/10.1002/PTR.2650080603
(3S,5S,9S,10S,13R,17R)-17-[(2R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol	91746710	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C	416.70	unknown	https://doi.org/10.1002/PTR.2650080603
(3S,6R)-6-[(8R,9S,10S,13R,14S,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3-propan-2-ylheptan-1-ol	56924079	Click to see CC(C)C(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCCC4)C)C)CCO	416.70	unknown	https://doi.org/10.1002/PTR.2650080603
(3S,8R,9R,10S,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	636741	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	via CMAUP database
(3S,8S,10R,13R)-17-[(5S)-5-ethyl-6-methylhept-6-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	6324940	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(=C)C	412.70	unknown	via CMAUP database
(3S,8S,9S,10R,13R,14S,17R)-17-((R,Z)-5-isopropylhept-5-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol	134687892	Click to see CC=C(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	https://doi.org/10.1002/PTR.2650080603
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	86821	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1007/BF00581591 https://doi.org/10.1002/PTR.2650080603
24-Ethylcholest-5-en-3beta-ol	22012	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1002/PTR.2650080603
5,25-Stigmastadienol	286499	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(=C)C	412.70	unknown	https://doi.org/10.1002/PTR.2650080603
alpha-Spinasterin	5281331	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	https://doi.org/10.1002/PTR.2650080603
Beta-Sitosterol	222284	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1007/BF00581591
beta-Sitosterol 3-O-beta-D-galactopyranoside	296119	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	https://doi.org/10.1007/BF00581591
Clerosterol	5283638	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(=C)C	412.70	unknown	https://doi.org/10.1002/PTR.2650080603
delta7-Avenasterol	12795736	Click to see CC=C(CCC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	https://doi.org/10.1002/PTR.2650080603
Fucosterol	5281326	Click to see CC=C(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	https://doi.org/10.1002/PTR.2650080603
Schottenol	441837	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1002/PTR.2650080603
Sitogluside	5742590	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	https://doi.org/10.1007/BF00581591
Stigmasterol	5280794	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	https://doi.org/10.1002/PTR.2650080603
> Nucleosides, nucleotides, and analogues / Purine nucleosides
2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one	6802	Click to see C1=NC2=C(N1C3C(C(C(O3)CO)O)O)NC(=NC2=O)N	283.24	unknown	via CMAUP database
Adenosine	60961	Click to see C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N	267.24	unknown	https://doi.org/10.1248/YAKUSHI1947.108.11_1101
> Nucleosides, nucleotides, and analogues / Pyrimidine nucleosides
Uridine	6029	Click to see C1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)O	244.20	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acids
Propionic Acid	1032	Click to see CCC(=O)O	74.08	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Tetracarboxylic acids and derivatives
[1-Acetyloxy-4a-hydroxy-6-(3-methylbutanoyloxy)spiro[1,5,6,7a-tetrahydrocyclopenta[c]pyran-7,2'-oxirane]-4-yl]methyl 3-methyl-2-(3-methylbutanoyloxy)butanoate	5318683	Click to see CC(C)CC(=O)OC1CC2(C(C13CO3)C(OC=C2COC(=O)C(C(C)C)OC(=O)CC(C)C)OC(=O)C)O	540.60	unknown	via CMAUP database
> Organic oxygen compounds / Organic oxides
Safranal	61041	Click to see CC1=C(C(CC=C1)(C)C)C=O	150.22	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols
(3S)-hexan-3-ol	638098	Click to see CCCC(CC)O	102.17	unknown	via CMAUP database
(S)-(+)-2-Hexanol	638097	Click to see CCCCC(C)O	102.17	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
(2R)-1-[2-(hydroxymethyl)-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-2-methylbut-3-en-2-ol	5321053	Click to see CC1(CCCC2(C1CC=C(C2CC(C)(C=C)O)CO)C)C	292.50	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Aminosaccharides / Aminoglycosides
Tylosin C	6440817	Click to see CCC1C(C=C(C=CC(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)O)(C)O)N(C)C)O)CC=O)C)C)COC4C(C(C(C(O4)C)O)O)OC	902.10	unknown	https://doi.org/10.1248/CPB.41.1796
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glucuronides / N-glucuronides
Kahakamide A	10339609	Click to see COC1=CC=CC2=C1C(=CN2C3C(C(CC(O3)C(=O)OC)O)O)CC(=O)N	378.40	unknown	https://doi.org/10.1248/CPB.40.3355
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / C-glycosyl compounds
(2E)-5-[(Z)-[3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-ylidene]-hydroxymethyl]-6-hydroxy-2-[1-hydroxy-3-(4-hydroxyphenyl)prop-2-enylidene]-6-[(2R,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohex-4-ene-1,3-dione	42607657	Click to see C1=CC(=CC=C1C=CC(=C2C(=O)C=C(C(C2=O)(C3C(C(C(C(O3)CO)O)O)O)O)C(=C4C(C(C(N4)CO)O)O)O)O)O	593.50	unknown	via CMAUP database
2,5-Cyclohexadien-1-one, 2,4-di-beta-D-glucopyranosyl-3,4,5-trihydroxy-6-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-	49798103	Click to see C1=CC(=CC=C1C=CC(=C2C(=C(C(=O)C(C2=O)(C3C(C(C(C(O3)CO)O)O)O)O)C4C(C(C(C(O4)CO)O)O)O)O)O)O	612.50	unknown	via CMAUP database
2,5-dihydroxy-6-[1-hydroxy-3-(4-hydroxyphenyl)prop-2-enylidene]-2-[(2S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohex-4-ene-1,3-dione	138113509	Click to see C1=CC(=CC=C1C=CC(=C2C(=C(C(=O)C(C2=O)(C3C(C(C(C(O3)CO)O)O)O)O)C4C(C(C(C(O4)CO)O)O)O)O)O)O	612.50	unknown	https://doi.org/10.1248/CPB.41.1796 https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1055/S-2003-39714
Hydroxysafflor Yellow A	6443665	Click to see C1=CC(=CC=C1C=CC(=C2C(=C(C(=O)C(C2=O)(C3C(C(C(C(O3)CO)O)O)O)O)C4C(C(C(C(O4)CO)O)O)O)O)O)O	612.50	unknown	https://doi.org/10.1248/CPB.41.1796
Tinctormine	129636912	Click to see C1=CC(=CC=C1C=CC(=C2C(=O)C=C(C(C2=O)(C3C(C(C(C(O3)CO)O)O)O)O)C(=C4C(C(C(N4)CO)O)O)O)O)O	593.50	unknown	https://doi.org/10.1248/CPB.41.1796
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
(6R,7S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-6,7-dihydrochromen-4-one	162969233	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(C(C(=C4C3=O)O)OC5C(C(C(C(O5)CO)O)O)O)O)C6=CC=C(C=C6)O)O)O)O)O)O)O	774.70	unknown	https://doi.org/10.1271/BBB.64.1588
2,5-dihydroxy-6-[(E)-1-hydroxy-3-(4-hydroxyphenyl)prop-2-enylidene]-2,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]cyclohex-4-ene-1,3-dione	102200539	Click to see C1=CC(=CC=C1C=CC(=C2C(=C(C(=O)C(C2=O)(O)OC3C(C(C(C(O3)CO)O)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O)O	644.50	unknown	via CMAUP database
4a-Hydroxy-4-(oxiran-2-yl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydropyrano[3,4-c]pyran-8-one	14543432	Click to see C1COC(=O)C2=COC(C(C21O)C3CO3)OC4C(C(C(C(O4)CO)O)O)O	390.34	unknown	https://doi.org/10.1002/CHIN.200047189
5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxy-6,7-dihydrochromen-4-one	162969232	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(C(C(=C4C3=O)O)OC5C(C(C(C(O5)CO)O)O)O)O)C6=CC=C(C=C6)O)O)O)O)O)O)O	774.70	unknown	https://doi.org/10.1271/BBB.64.1588
hydrangeifolin I	10549806	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC3=CC=CC=C3)O)O)O)O)O)O	416.40	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-[5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1H-indol-3-yl]ethyl]prop-2-enamide	101933130	Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CNC3=C2C=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)O	514.50	unknown	https://doi.org/10.1248/CPB.44.874
(E)-3-(4-hydroxyphenyl)-N-[2-[5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1H-indol-3-yl]ethyl]prop-2-enamide	44200708	Click to see C1=CC(=CC=C1C=CC(=O)NCCC2=CNC3=C2C=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)O	484.50	unknown	https://doi.org/10.1271/BBB1961.49.2969 https://doi.org/10.1248/CPB.44.874 https://doi.org/10.1271/BBB1961.44.2951
(Z)-Syringin	9799599	Click to see COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C=CCO	372.40	unknown	via CMAUP database
3-(4-hydroxy-3-methoxyphenyl)-N-[2-[5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1H-indol-3-yl]ethyl]prop-2-enamide	162871428	Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CNC3=C2C=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)O	514.50	unknown	https://doi.org/10.1248/CPB.44.874
3-(4-hydroxyphenyl)-N-[2-[5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1H-indol-3-yl]ethyl]prop-2-enamide	74949615	Click to see C1=CC(=CC=C1C=CC(=O)NCCC2=CNC3=C2C=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)O	484.50	unknown	https://doi.org/10.1271/BBB1961.49.2969 https://doi.org/10.1248/CPB.44.874 https://doi.org/10.1271/BBB1961.44.2951
3-[4-[3,4,5-Trihydroxy-6-[(4-hydroxybenzoyl)oxymethyl]oxan-2-yl]oxyphenyl]prop-2-enoic acid	162972089	Click to see C1=CC(=CC=C1C=CC(=O)O)OC2C(C(C(C(O2)COC(=O)C3=CC=C(C=C3)O)O)O)O	446.40	unknown	https://doi.org/10.1016/S0031-9422(00)94175-X
Eleutheroside B	5316860	Click to see COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C=CCO	372.40	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Aryl-aldehydes
5-Hydroxymethylfurfural	237332	Click to see C1=C(OC(=C1)C=O)CO	126.11	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
Dodecanal	8194	Click to see CCCCCCCCCCCC=O	184.32	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha-haloketones / Alpha-chloroketones
CID 53630748	53630748	Click to see C(C(=O)CCl)[O]	107.51	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aryl ketones / Aryl alkyl ketones
5-Acetyl-2-furanmethanol	580381	Click to see CC(=O)C1=CC=C(O1)CO	140.14	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzaldehydes / Hydroxybenzaldehydes
4-Hydroxybenzaldehyde	126	Click to see C1=CC(=CC=C1C=O)O	122.12	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones
3,4-Dihydroxy-5-oxocyclohexene-1-carboxylic acid	4635868	Click to see C1C(=CC(C(C1=O)O)O)C(=O)O	172.13	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones
4'-Hydroxyacetophenone	7469	Click to see CC(=O)C1=CC=C(C=C1)O	136.15	unknown	via CMAUP database
Paeonol	11092	Click to see CC(=O)C1=C(C=C(C=C1)OC)O	166.17	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Quinomethanes / P-quinomethanes
Kinobeon A	10237057	Click to see COC1=CC(=CC=CC=C2C=C(C(=O)C(=C2)OC)OC)C=C(C1=O)OC	356.40	unknown	https://doi.org/10.1055/S-2003-39708 https://doi.org/10.1016/J.LFS.2003.06.033 https://doi.org/10.1515/ZNC-1994-1-201
> Organohalogen compounds / Halohydrins / Chlorohydrins
(2S,3E,11E)-1-chlorotrideca-3,11-dien-5,7,9-triyn-2-ol	162849708	Click to see CC=CC#CC#CC#CC=CC(CCl)O	218.68	unknown	https://doi.org/10.1002/CBER.19660991107
(2S,3E,11E)-2-chlorotrideca-3,11-dien-5,7,9-triyn-1-ol	92254817	Click to see CC=CC#CC#CC#CC=CC(CO)Cl	218.68	unknown	https://doi.org/10.1002/CBER.19660991107
(E,2S)-2-chlorotridec-3-en-5,7,9,11-tetrayn-1-ol	162885495	Click to see CC#CC#CC#CC#CC=CC(CO)Cl	216.66	unknown	https://doi.org/10.1002/CBER.19660991107
1-Chlorotrideca-3,11-dien-5,7,9-triyn-2-ol	85927507	Click to see CC=CC#CC#CC#CC=CC(CCl)O	218.68	unknown	https://doi.org/10.1002/CBER.19660991107
2-Chlorotridec-3-en-5,7,9,11-tetrayn-1-ol	85927511	Click to see CC#CC#CC#CC#CC=CC(CO)Cl	216.66	unknown	https://doi.org/10.1002/CBER.19660991107
2-Chlorotrideca-3,11-dien-5,7,9-triyn-1-ol	102739	Click to see CC=CC#CC#CC#CC=CC(CO)Cl	218.68	unknown	https://doi.org/10.1002/CBER.19660991107
> Organoheterocyclic compounds / Benzodioxoles
Myristicin	4276	Click to see COC1=CC(=CC2=C1OCO2)CC=C	192.21	unknown	via CMAUP database
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Xanthones
1,3,6-Trihydroxy-2,7-dimethoxyxanthen-9-one	5320291	Click to see COC1=C(C=C2C(=C1)C(=O)C3=C(O2)C=C(C(=C3O)OC)O)O	304.25	unknown	via CMAUP database
Onjixanthone I	5320290	Click to see COC1=C(C(=C2C(=C1)OC3=C(C2=O)C=C(C=C3)O)OC)OC	302.28	unknown	via CMAUP database
> Organoheterocyclic compounds / Benzothiazoles
4-(1,3-Benzothiazol-2-yl)-2-methylaniline	384525	Click to see CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)N	240.33	unknown	via CMAUP database
Benzothiazole	7222	Click to see C1=CC=C2C(=C1)N=CS2	135.19	unknown	via CMAUP database
> Organoheterocyclic compounds / Diazines / Pyrimidines and pyrimidine derivatives / Hydroxypyrimidines
5-methylpyrimidine-2,4-diol	5274265	Click to see CC1=CN=C(N=C1O)O	126.11	unknown	via CMAUP database
> Organoheterocyclic compounds / Diazines / Pyrimidines and pyrimidine derivatives / Pyrimidones
Uracil	1174	Click to see C1=CNC(=O)NC1=O	112.09	unknown	via CMAUP database
> Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / 6-aminopurines
Adenine	190	Click to see C1=NC2=NC=NC(=C2N1)N	135.13	unknown	via CMAUP database
> Organoheterocyclic compounds / Indoles and derivatives
(1S,4R,7R,8R,11R,12S,13R)-1-hydroxy-2,12-dimethyl-13-propan-2-yl-10-oxa-2-azatetracyclo[5.4.1.18,11.04,12]tridecan-9-one	162843029	Click to see CC(C)C1C2C3CCC4C3(C(C1OC2=O)(N(C4)C)O)C	279.37	unknown	https://doi.org/10.1248/CPB.40.3355
> Organoheterocyclic compounds / Indoles and derivatives / Hydroxyindoles
N-[2-[5-hydroxy-4-[5-hydroxy-3-[2-[3-(4-hydroxyphenyl)prop-2-enoylamino]ethyl]-1H-indol-4-yl]-1H-indol-3-yl]ethyl]-3-(4-hydroxyphenyl)prop-2-enamide	73091705	Click to see C1=CC(=CC=C1C=CC(=O)NCCC2=CNC3=C2C(=C(C=C3)O)C4=C(C=CC5=C4C(=CN5)CCNC(=O)C=CC6=CC=C(C=C6)O)O)O	642.70	unknown	https://doi.org/10.1248/CPB.44.874
> Organoheterocyclic compounds / Indoles and derivatives / Indoles
Indole-3-carboxaldehyde	10256	Click to see C1=CC=C2C(=C1)C(=CN2)C=O	145.16	unknown	via CMAUP database
> Organoheterocyclic compounds / Indoles and derivatives / Tryptamines and derivatives / Serotonins / N-acylserotonins
(E,E)-4,4''-Bi(N-4-hydroxycinnamoylserotonin)	11764751	Click to see C1=CC(=CC=C1C=CC(=O)NCCC2=CNC3=C2C(=C(C=C3)O)C4=C(C=CC5=C4C(=CN5)CCNC(=O)C=CC6=CC=C(C=C6)O)O)O	642.70	unknown	https://doi.org/10.1248/CPB.44.874
4-[N-(p-Coumaroyl)serotonin-4''-yl]-N-feruloylserotonin	10484617	Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CNC3=C2C(=C(C=C3)O)C4=C(C=CC5=C4C(=CN5)CCNC(=O)C=CC6=CC=C(C=C6)O)O)O	672.70	unknown	https://doi.org/10.1248/CPB.44.874
Moschamine	5969616	Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CNC3=C2C=C(C=C3)O)O	352.40	unknown	https://doi.org/10.1248/CPB.44.874 https://doi.org/10.1271/BBB1961.49.2969 https://doi.org/10.1248/BPB.27.1976 https://doi.org/10.1271/BBB1961.44.2951
N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide	340062	Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CNC3=C2C=C(C=C3)O)O	352.40	unknown	https://doi.org/10.1248/BPB.27.1976 https://doi.org/10.1271/BBB1961.49.2969 https://doi.org/10.1248/CPB.44.874 https://doi.org/10.1271/BBB1961.44.2951
N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-(4-hydroxyphenyl)prop-2-enamide	340063	Click to see C1=CC(=CC=C1C=CC(=O)NCCC2=CNC3=C2C=C(C=C3)O)O	322.40	unknown	https://doi.org/10.1248/CPB.44.874 https://doi.org/10.1271/BBB1961.49.2969 https://doi.org/10.1248/BPB.27.1976 https://doi.org/10.1271/BBB1961.44.2951
N-Coumaroyl serotonin	5458879	Click to see C1=CC(=CC=C1C=CC(=O)NCCC2=CNC3=C2C=C(C=C3)O)O	322.40	unknown	https://doi.org/10.1248/CPB.44.874 https://doi.org/10.1271/BBB1961.49.2969 https://doi.org/10.1248/BPB.27.1976 https://doi.org/10.1271/BBB1961.44.2951
> Organoheterocyclic compounds / Naphthopyrans / Naphthopyranones
Isoversiol B	139589746	Click to see CC1CC(C2C(=C1)C=CC3(C2(C(=O)CCO3)C)C)O	262.34	unknown	https://doi.org/10.1271/BBB.64.1588
> Organoheterocyclic compounds / Pyrans / Pyranones and derivatives / Dihydropyranones
(1R,5R,6R,7S)-1-(hydroxymethyl)-7-(4-hydroxyphenyl)-4-oxo-8-oxabicyclo[3.2.1]oct-2-ene-6-carboxylic acid	10803414	Click to see C1=CC(=CC=C1C2C(C3C(=O)C=CC2(O3)CO)C(=O)O)O	290.27	unknown	https://doi.org/10.1021/NP000140M
Cartorimine	3461265	Click to see C1=CC(=CC=C1C2C(C3C(=O)C=CC2(O3)CO)C(=O)O)O	290.27	unknown	https://doi.org/10.1021/NP000140M
> Organoheterocyclic compounds / Tetrahydrofurans
Massarigenin A	637134	Click to see CC1C=CC(C(C12C(C(=C)OC2=O)O)O)O	226.23	unknown	https://doi.org/10.1248/CPB.41.1796
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
3-(4-Hydroxy-3-methoxyphenyl)-2-oxa-6,11-diazatetracyclo[7.5.2.04,15.012,16]hexadeca-1(15),9,12(16),13-tetraen-5-one	73074609	Click to see COC1=C(C=CC(=C1)C2C3C4=C(O2)C=CC5=C4C(=CN5)CCNC3=O)O	350.40	unknown	https://doi.org/10.1271/BBB1961.49.2969
7-Methoxy-3-methyl-5-prop-1-enyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran	632845	Click to see CC=CC1=CC2=C(C(=C1)OC)OC(C2C)C3=CC(=C(C(=C3)OC)OC)OC	370.40	unknown	https://doi.org/10.1271/BBB.64.1588
Serotobenine	11725426	Click to see COC1=C(C=CC(=C1)C2C3C4=C(O2)C=CC5=C4C(=CN5)CCNC3=O)O	350.40	unknown	https://doi.org/10.1271/BBB1961.49.2969
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives
(2Z,6S)-5,6-dihydroxy-4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-[[(3R)-2,3,4-trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1-yl]methylidene]cyclohex-4-ene-1,3-dione	163191455	Click to see C1=CC(=CC=C1C=CC(=O)C2=C(C(C(=C(C2=O)C=C3C(=O)C(=C(C(C3=O)(C4C(C(C(C(O4)CO)O)O)O)O)O)C(=O)C=CC5=CC=C(C=C5)O)O)(C6C(C(C(C(O6)CO)O)O)O)O)O)O	910.80	unknown	https://doi.org/10.1271/BBB.64.1588
(2Z,6S)-5,6-dihydroxy-4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-[[2,3,4-trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1-yl]methylidene]cyclohex-4-ene-1,3-dione	137208345	Click to see C1=CC(=CC=C1C=CC(=O)C2=C(C(C(=C(C2=O)C=C3C(=O)C(=C(C(C3=O)(C4C(C(C(C(O4)CO)O)O)O)O)O)C(=O)C=CC5=CC=C(C=C5)O)O)(C6C(C(C(C(O6)CO)O)O)O)O)O)O	910.80	unknown	https://doi.org/10.3136/FSTR.5.265 https://doi.org/10.1007/BF02005873 https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1021/NP50091A006 https://doi.org/10.1248/CPB.41.1796 https://doi.org/10.1246/CL.1995.901 https://doi.org/10.1007/BF02975225 https://doi.org/10.1021/JF9911038
(4R)-4-hydroxy-2-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-4,6-bis[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-2,5-dien-1-one	163188473	Click to see C1=CC(=CC=C1C=CC(=O)C2=CC(C=C(C2=O)C3C(C(C(C(O3)CO)O)O)O)(C4C(C(C(C(O4)CO)O)O)O)O)O	580.50	unknown	https://doi.org/10.1002/CBDV.200800313
(7R)-2-[(2S,3R,4R)-3,4-dihydroxyoxolan-2-yl]-4,7-dihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1H-indol-6-one	101020171	Click to see C1C(C(C(O1)C2=CC3=C(N2)C(C(=O)C(=C3O)C(=O)C=CC4=CC=C(C=C4)O)(C5C(C(C(C(O5)CO)O)O)O)O)O)O	575.50	unknown	via CMAUP database
3-(4-Hydroxy-3-methoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]-2-propenamide	20981091	Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CNC3=CC=CC=C32)O	336.40	unknown	https://doi.org/10.1271/BBB1961.49.2969
3,4,6,7-Tetrahydroxy-2-(hydroxymethyl)-8-[(2E)-3-(4-hydroxyphenyl)-2-propenoyl]-9-oxo-3,4,4a,6,9,9b-hexahydro-2H-pyrano[3,2-b][1]benzo[b]furan-6-yl beta-D-glucopyranoside	71463725	Click to see C1=CC(=CC=C1C=CC(=O)C2=C(C3=C(C(C2=O)(O)OC4C(C(C(C(O4)CO)O)O)O)OC5C3OC(C(C5O)O)CO)O)O	610.50	unknown	via CMAUP database
4-Cyclohexene-1,3-dione, 6-beta-D-glucopyranosyl-2-[[3-beta-D-glucopyranosyl-2,3,4-trihydroxy-5-[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-6-oxo-1,4-cyclohexadien-1-yl]methylene]-5,6-dihydroxy-4-[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-	11968069	Click to see C1=CC(=CC=C1C=CC(=O)C2=C(C(=CC3=C(C(=C(C=CC4=CC=C(C=C4)O)O)C(=O)C(C3=O)(C5C(C(C(C(O5)CO)O)O)O)O)O)C(=O)C(C2=O)(C6C(C(C(C(O6)CO)O)O)O)O)O)O	910.80	unknown	via CMAUP database
4-Hydroxy-2-[3-(4-hydroxyphenyl)prop-2-enoyl]-4,6-bis[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-2,5-dien-1-one	162910232	Click to see C1=CC(=CC=C1C=CC(=O)C2=CC(C=C(C2=O)C3C(C(C(C(O3)CO)O)O)O)(C4C(C(C(C(O4)CO)O)O)O)O)O	580.50	unknown	https://doi.org/10.1002/CBDV.200800313
5-hydroxy-4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexa-3,5-diene-1,2-dione	12305281	Click to see C1=CC(=CC=C1C=CC(=O)C2=C(C(=O)C(=O)C=C2O)OC3C(C(C(C(O3)CO)O)O)O)O	448.40	unknown	via CMAUP database
5,6-Dihydroxy-4-[3-(4-hydroxyphenyl)prop-2-enoyl]-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-[[2,3,4-trihydroxy-5-[3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1-yl]methylidene]cyclohex-4-ene-1,3-dione	139597671	Click to see C1=CC(=CC=C1C=CC(=O)C2=C(C(C(=C(C2=O)C=C3C(=O)C(=C(C(C3=O)(C4C(C(C(C(O4)CO)O)O)O)O)O)C(=O)C=CC5=CC=C(C=C5)O)O)(C6C(C(C(C(O6)CO)O)O)O)O)O)O	910.80	unknown	https://doi.org/10.1271/BBB.64.1588
6-[[2,5-dihydroxy-3-[(E)-1-hydroxy-3-(4-hydroxyphenyl)prop-2-enylidene]-4,6-dioxo-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexen-1-yl]methylidene]-2,5-dihydroxy-4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohex-4-ene-1,3-dione	101973288	Click to see C1=CC(=CC=C1C=CC(=O)C2=C(C(=CC3=C(C(=C(C=CC4=CC=C(C=C4)O)O)C(=O)C(C3=O)(C5C(C(C(C(O5)CO)O)O)O)O)O)C(=O)C(C2=O)(C6C(C(C(C(O6)CO)O)O)O)O)O)O	910.80	unknown	via CMAUP database
Anhydrosafflor yellow B	102240413	Click to see C1=CC(=CC=C1C=CC(=O)C2=C(C3=C(C(C2=O)(C4C(C(C(C(O4)CO)O)O)O)O)OC(C3C5=C(C(=C(C=CC6=CC=C(C=C6)O)O)C(=O)C(C5=O)(C7C(C(C(C(O7)CO)O)O)O)O)O)C(C(C(CO)O)O)O)O)O	1044.90	unknown	via CMAUP database
Anhydrosafflor yellow B	145708070	Click to see C1=CC(=CC=C1C=CC(=O)C2=C(C3=C(C(C2=O)(C4C(C(C(C(O4)CO)O)O)O)O)OC(C3C5=C(C(=C(C=CC6=CC=C(C=C6)O)O)C(=O)C(C5=O)(C7C(C(C(C(O7)CO)O)O)O)O)O)C(C(C(CO)O)O)O)O)O	1044.90	unknown	https://doi.org/10.1271/BBB.64.1588
Carthamic acid	45358114	Click to see C1=CC(=CC=C1C=CC(=O)C2=C(C(=CC3=C(C(=C(C=CC4=CC=C(C=C4)O)O)C(=O)C(C3=O)(C5C(C(C(C(O5)CO)O)O)O)O)O)C(=O)C(C2=O)(C6C(C(C(C(O6)CO)O)O)O)O)O)O	910.80	unknown	via CMAUP database
Cartormin	131751684	Click to see C1C(C(C(O1)C2=CC3=C(N2)C(C(=O)C(=C3O)C(=O)C=CC4=CC=C(C=C4)O)(C5C(C(C(C(O5)CO)O)O)O)O)O)O	575.50	unknown	https://doi.org/10.1016/S0040-4039(00)00100-3
Nb-Feruloyltryptamine	641764	Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CNC3=CC=CC=C32)O	336.40	unknown	https://doi.org/10.1271/BBB1961.49.2969
Saffloquinoside A	45276863	Click to see C1C(C(C(C2(O1)CC3=C(O2)C(C(=O)C(=C3O)C(=O)C=CC4=CC=C(C=C4)O)(C5C(C(C(C(O5)CO)O)O)O)O)O)O)O	594.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
3-(4-Hydroxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]-2-propenamide	66803733	Click to see C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C=CC3=CC=C(C=C3)O	306.40	unknown	https://doi.org/10.1271/BBB1961.49.2969
Nb-p-Coumaroyltryptamine	5458878	Click to see C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C=CC3=CC=C(C=C3)O	306.40	unknown	https://doi.org/10.1271/BBB1961.49.2969
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
(E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid	2518	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1
4-Hydroxycinnamic acid	322	Click to see C1=CC(=CC=C1C=CC(=O)O)O	164.16	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1
Caffeic Acid	689043	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1
cis-Caffeic acid	1549111	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	via CMAUP database
cis-p-Coumaric acid	1549106	Click to see C1=CC(=CC=C1C=CC(=O)O)O	164.16	unknown	via CMAUP database
Ferulic acid	445858	Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O	194.18	unknown	via CMAUP database
p-Coumaric acid	637542	Click to see C1=CC(=CC=C1C=CC(=O)O)O	164.16	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 6,7-dihydroxycoumarins
Esculetin	5281416	Click to see C1=CC(=O)OC2=CC(=C(C=C21)O)O	178.14	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins
Daphnoretin	5281406	Click to see COC1=C(C=C2C(=C1)C=C(C(=O)O2)OC3=CC4=C(C=C3)C=CC(=O)O4)O	352.30	unknown	https://doi.org/10.1023/B:CONC.0000025456.09089.84
Umbelliferone	5281426	Click to see C1=CC(=CC2=C1C=CC(=O)O2)O	162.14	unknown	https://doi.org/10.1023/B:CONC.0000025456.09089.84
> Phenylpropanoids and polyketides / Diarylheptanoids / Linear diarylheptanoids
3,4-Dihydroxyrottlerin	5316826	Click to see CC1=C(C(=C(C(=C1O)C(=O)C)O)CC2=C(C(=C3C(=C2O)C=CC(O3)(C)C)C(=O)C=CC4=CC(=C(C=C4)O)O)O)O	548.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Diarylheptanoids / Linear diarylheptanoids / Curcuminoids
3-[2,5-dihydroxy-3-[(E)-1-hydroxy-3-(4-hydroxyphenyl)prop-2-enylidene]-4,6-dioxo-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexen-1-yl]-3-(4-hydroxyphenyl)propanoic acid	101616857	Click to see C1=CC(=CC=C1C=CC(=C2C(=C(C(=O)C(C2=O)(C3C(C(C(C(O3)CO)O)O)O)O)C(CC(=O)O)C4=CC=C(C=C4)O)O)O)O	614.50	unknown	https://doi.org/10.1246/CL.1989.1571 https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1248/CPB.41.1796
Safflomin C	42607658	Click to see C1=CC(=CC=C1C=CC(=C2C(=C(C(=O)C(C2=O)(C3C(C(C(C(O3)CO)O)O)O)O)C(CC(=O)O)C4=CC=C(C=C4)O)O)O)O	614.50	unknown	via CMAUP database
Saffloquinoside B	101501319	Click to see C1=CC(=CC=C1CC2(C(=O)C(=C(C=CC3=CC=C(C=C3)O)O)C(=O)C(C2=O)(C4C(C(C(C(O4)CO)O)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O	718.70	unknown	https://doi.org/10.1021/OL902971W
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones
5,6,7-Trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one	9879022	Click to see C1C(OC2=C(C1=O)C(=C(C(=C2)O)O)O)C3=CC=C(C=C3)O	288.25	unknown	via CMAUP database
Carthamidin	188308	Click to see C1C(OC2=C(C1=O)C(=C(C(=C2)O)O)O)C3=CC=C(C=C3)O	288.25	unknown	via CMAUP database
Eriodictyol	440735	Click to see C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC(=C(C=C3)O)O	288.25	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1
> Phenylpropanoids and polyketides / Flavonoids / Flavones
Apigenin	5280443	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O	270.24	unknown	https://doi.org/10.1023/B:CONC.0000025456.09089.84 https://doi.org/10.1016/S0031-9422(00)97572-1
Kaempferol oxoanion	25202062	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)[O-])O	285.23	unknown	via CMAUP database
Luteolin	5280445	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O	286.24	unknown	https://doi.org/10.1023/B:CONC.0000025456.09089.84 https://doi.org/10.1007/BF02976632
Quercetin-7-olate	46906036	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)[O-])O)O	301.23	unknown	via CMAUP database
Scutellarein	5281697	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)O)O)O	286.24	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
6-Hydroxykaempferol	5281638	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(O2)C=C(C(=C3O)O)O)O)O	302.23	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1
6-Methoxykaempferol	5377945	Click to see COC1=C(C2=C(C=C1O)OC(=C(C2=O)O)C3=CC=C(C=C3)O)O	316.26	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1
Isorhamnetin	5281654	Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O	316.26	unknown	https://doi.org/10.1023/B:CONC.0000025456.09089.84
Kaempferol	5280863	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O	286.24	unknown	https://doi.org/10.1271/BBB1961.49.1851 https://doi.org/10.1016/S0031-9422(00)97572-1
Quercetin	5280343	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O	302.23	unknown	https://doi.org/10.1007/BF02976632 https://doi.org/10.1016/S0031-9422(00)97572-1 https://doi.org/10.1023/B:CONC.0000025456.09089.84
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-3-O-glucuronides
(2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4-dihydroxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxane-2-carboxylic acid	101005582	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)C(=O)O)O)O)O)O)O	624.50	unknown	https://doi.org/10.1271/BBB.64.1588
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-7-O-glucuronides
3,4,5-Trihydroxy-6-[5-hydroxy-2-(4-methoxyphenyl)-4-oxochromen-7-yl]oxyoxane-2-carboxylic acid	73192461	Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O	460.40	unknown	https://doi.org/10.1007/BF02976632
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
(E)-3-(4-hydroxyphenyl)-1-[2,3,5-trihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one	102116629	Click to see C1=CC(=CC=C1C=CC(=O)C2=CC(=C(C(=C2O)O)OC3C(C(C(C(O3)CO)O)O)O)O)O	450.40	unknown	via CMAUP database
Neocarthamin	46173973	Click to see C1C(OC2=C(C1=O)C(=C(C(=C2)O)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC=C(C=C4)O	450.40	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
[2-(3,4-Dihydroxyphenyl)-5-hydroxy-4-oxo-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-7-yl] 3,4,5,6-tetrahydroxyoxane-2-carboxylate	162901875	Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)OC(=O)C4C(C(C(C(O4)O)O)O)O)C5=CC(=C(C=C5)O)O)O)O)O	624.50	unknown	https://doi.org/10.1271/BBB.64.1588
[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-7-yl] (2S,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxane-2-carboxylate	162901876	Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)OC(=O)C4C(C(C(C(O4)O)O)O)O)C5=CC(=C(C=C5)O)O)O)O)O	624.50	unknown	https://doi.org/10.1271/BBB.64.1588
[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-7-yl] (2S,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxane-2-carboxylate	163022265	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)OC(=O)C4C(C(C(C(O4)O)O)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O	624.50	unknown	https://doi.org/10.1271/BBB.64.1588
[5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-7-yl] 3,4,5,6-tetrahydroxyoxane-2-carboxylate	163022264	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)OC(=O)C4C(C(C(C(O4)O)O)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O	624.50	unknown	https://doi.org/10.1271/BBB.64.1588
[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,6-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-7-yl] (2S,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxane-2-carboxylate	163033452	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C(=C(C=C3O2)OC(=O)C4C(C(C(C(O4)O)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)OC6C(C(C(C(O6)CO)O)O)O)O	802.60	unknown	https://doi.org/10.1271/BBB.64.1588
[5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,6-bis[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-7-yl] 3,4,5,6-tetrahydroxyoxane-2-carboxylate	163033451	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C(=C(C=C3O2)OC(=O)C4C(C(C(C(O4)O)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)OC6C(C(C(C(O6)CO)O)O)O)O	802.60	unknown	https://doi.org/10.1271/BBB.64.1588
2-(2,3-Dihydroxyphenyl)-5,7-dihydroxy-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one	53399169	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=C(C(=CC=C5)O)O)O)O)O)O)O)O	610.50	unknown	via CMAUP database
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	51402807	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O	464.40	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1 https://doi.org/10.1007/BF02329612
3-[4,5-Dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one	13647412	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O	610.50	unknown	https://doi.org/10.1271/BBB.64.1588
5,6,7-Trihydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	123245871	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(O2)C=C(C(=C3O)O)O)OC4C(C(C(C(O4)CO)O)O)O)O	464.40	unknown	https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1016/S0031-9422(00)97572-1
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one	11376821	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O	594.50	unknown	https://doi.org/10.1002/CBDV.200800313
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one	122173234	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O	594.50	unknown	https://doi.org/10.1271/BBB.64.1588
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one	20055286	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O	594.50	unknown	via CMAUP database
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,4R,5S)-3,4,5-trihydroxy-6-[[(2R,4R,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one	24211973	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O	594.50	unknown	via CMAUP database
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	5462193	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O	448.40	unknown	https://doi.org/10.1271/BBB.64.1588
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one	12313332	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O	594.50	unknown	https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1002/CBDV.200800313
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3,6-bis[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one	14375136	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(O2)C=C(C(=C3O)OC4C(C(C(C(O4)CO)O)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O	626.50	unknown	https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1016/S0031-9422(00)97572-1
6-Hydroxykaempferol 3-O-beta-D-glucoside	85469293	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(O2)C=C(C(=C3O)O)O)OC4C(C(C(C(O4)CO)O)O)O)O	464.40	unknown	https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1016/S0031-9422(00)97572-1
6-Hydroxykaempferol 3-rutinoside 6-glucoside	74978444	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=C(C3=O)C(=C(C(=C4)O)OC5C(C(C(C(O5)CO)O)O)O)O)C6=CC=C(C=C6)O)O)O)O)O)O)O	772.70	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1
6-Hydroxykaempferol 3-Rutinoside-6-glucoside	101637090	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=C(C3=O)C(=C(C(=C4)O)OC5C(C(C(C(O5)CO)O)O)O)O)C6=CC=C(C=C6)O)O)O)O)O)O)O	772.70	unknown	https://doi.org/10.1016/S0031-9422(00)97572-1
6-Hydroxykaempferol 3,6-diglucoside	14375137	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(O2)C=C(C(=C3O)OC4C(C(C(C(O4)CO)O)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O	626.50	unknown	https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1016/S0031-9422(00)97572-1
Astragalin	5282102	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O	448.40	unknown	https://doi.org/10.1007/S10600-014-0983-Z https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1016/S0031-9422(00)97572-1
Isoquercetin	5280804	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O	464.40	unknown	via CMAUP database
Kaempferol-3-O-rutinoside	5318767	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O	594.50	unknown	https://doi.org/10.1007/S10600-014-0983-Z https://doi.org/10.1016/S0031-9422(00)97572-1 https://doi.org/10.1271/BBB.64.1588
Rutin	5280805	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O	610.50	unknown	https://doi.org/10.1007/S10600-014-0983-Z https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1016/S0031-9422(00)97572-1
Sophoraflavonoloside	5282155	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O	610.50	unknown	https://doi.org/10.1271/BBB.64.1588
Venoruton	24832108	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O	610.50	unknown	https://doi.org/10.1271/BBB.64.1588
Vitamin P	5293655	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O	610.50	unknown	https://doi.org/10.1271/BBB.64.1588
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
[(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate	162968742	Click to see CC(=O)OCC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)O)C4=CC(=C(C=C4)O)O)O)O)O)O	506.40	unknown	https://doi.org/10.1007/BF02976632
2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	44259225	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O	464.40	unknown	https://doi.org/10.1007/BF02976632 https://doi.org/10.1007/S10600-014-0983-Z
3,5,6-trihydroxy-2-(4-hydroxyphenyl)-7-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	10434572	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O	464.40	unknown	via CMAUP database
5-Hydroxy-2-(4-hydroxyphenyl)-3,6,7-tris[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one	74978445	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)OC6C(C(C(C(O6)CO)O)O)O)O	788.70	unknown	https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1016/S0031-9422(00)97572-1
5-hydroxy-2-(4-methoxyphenyl)-7-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one	102442676	Click to see CC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=C(C=C4)OC)O)O)O)O	430.40	unknown	https://doi.org/10.1002/CHIN.200047189
6-Hydroxykaempferol-3,6,7-triglucoside	101634597	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)OC6C(C(C(C(O6)CO)O)O)O)O	788.70	unknown	https://doi.org/10.1271/BBB.64.1588 https://doi.org/10.1016/S0031-9422(00)97572-1
Acacetin 7-[apiosyl(1->6)-glucoside]	74977556	Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)COC5C(C(CO5)(CO)O)O)O)O)O)O	578.50	unknown	https://doi.org/10.1002/CHIN.200047189
Acacetin 7-apiosylglucoside	10303631	Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)COC5C(C(CO5)(CO)O)O)O)O)O)O	578.50	unknown	https://doi.org/10.1002/CHIN.200047189
kaempferol 7-O-glucoside	10095180	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O	448.40	unknown	https://doi.org/10.1002/CHIN.200047189
Kaempferol-7-o-glucoside	5480982	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O	448.40	unknown	https://doi.org/10.1002/CHIN.200047189
Luteolin 7-O-glucoside	5280637	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O	448.40	unknown	https://doi.org/10.1007/BF02976632
Quercetin 7-O-glucoside	5381351	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O	464.40	unknown	https://doi.org/10.1007/BF02976632 https://doi.org/10.1007/S10600-014-0983-Z
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-8-O-glycosides
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis[[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy]chromen-4-one	162936687	Click to see C1C(C(C(C(O1)OC2=C(C(=C3C(=C2O)C(=O)C=C(O3)C4=CC(=C(C=C4)O)O)OC5C(C(C(CO5)O)O)O)O)O)O)O	582.50	unknown	https://doi.org/10.1271/BBB.64.1588
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 4-O-methylated flavonoids
Acacetin	5280442	Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O	284.26	unknown	https://doi.org/10.1002/CHIN.200047189 https://doi.org/10.1080/00021369.1980.10864416 https://doi.org/10.1271/BBB1961.44.2951 https://doi.org/10.1023/B:CONC.0000025456.09089.84 https://doi.org/10.1248/BPB.27.1976
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 6-O-methylated flavonoids
Hispidulin 7-sulfate	13831736	Click to see COC1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC=C(C=C3)O)OS(=O)(=O)O	380.30	unknown	https://doi.org/10.1021/OL902971W
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids
Tephrowatsin B	44257205	Click to see CC(=CCC1=C(C=C(C2=C1OC(C=C2)C3=CC=CC=C3)OC)OC)C	336.40	unknown	https://doi.org/10.1021/OL902971W
> Phenylpropanoids and polyketides / Macrolide lactams
Dihydro-FK-506	13819087	Click to see CCCC1C=C(CC(CC(C2C(CC(C(O2)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C(CC1=O)O)C)C(=CC4CCC(C(C4)OC)O)C)O)C)OC)OC)C)C	806.00	unknown	https://doi.org/10.1021/OL902971W

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Carthamus tinctorius

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