Ziziphus jujuba

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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	UUID643ffbeeda9a1756381525
Scientific name	Ziziphus jujuba
Authority	Mill.
First published in	Gard. Dict. ed. 8 : n.º 1 (1768)

Description Top

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Synonyms Top

Scientific name	Authority	First published in
Jububa mediterranea	Bubani	Fl. Pyren. 1: 376 (1897)
Ziziphus sativa	Gaertn.	Fruct. Sem. Pl. 1: 202 (1788)
Ziziphus officinarum	Medik.	Bot. Beob. 1782 : 333 (1783)
Ziziphus nitida	Roxb.	Fl. Ind. 2: 358 (1824)
Ziziphus poiretii	G.Don	Gen. Hist. 2: 26. 1832 [Oct 1832]
Ziziphus melanogona	Bojer	Hortus Maurit. : 69 (1837)
Ziziphus trinervia	Roth	Nov. Pl. Sp. 168. 1821 [Apr 1821]
Ziziphus sinensis	Lam.	Encycl. 3: 317 (1789)
Ziziphus soporifera	(Lour.) Stokes	Bot. Mat. Med. 1: 433 (1812)
Ziziphus sororia	Roem. & Schult.	Syst. Veg., ed. 15 bis 5: 337 (1819)
Zizyphon jujubum	St.-Lag.	Ann. Soc. Bot. Lyon 7: 70 (1880)
Ziziphus vulgaris	Lam.	Encycl. 3: 316 (1789)
Ziziphus zizyphus	(L.) H.Karst.	Deut. Fl. : 870 (1882)
Ziziphus chinensis	Spreng.	Syst. Veg. 1: 770 (1824)
Ziziphus acidojujuba	C.Y.Cheng & M.J.Liu	J. Hebei Agric. Univ. 17(4): 3 (1994)
Mansana arborea	J.F.Gmel.	Syst. Nat. ed. 13[bis] : 580 (1791)
Rhamnus soporifera	Lour.	Fl. Cochinch. : 158 (1790)
Rhamnus vulgaris	Pers.	Syn. Pl. 1: 240 (1805)
Rhamnus zizyphus	L.	Sp. Pl. : 194 (1753)
Rhamnus lucida	Salisb.	Prodr. Stirp. Chap. Allerton : 139 (1796)
Rhamnus mauritiana	P.Willemet	Ann. Bot. (Usteri) 18: 20 (1796)
Paliurus lucidus	Carrière	Rev. Hort. (Paris) 37: 380 (1866)
Ziziphus mauritiana var. muratiana	(Maire) A.Chev.	Rev. Bot. Appl. Agric. Trop. 32: 576 1952
Ziziphus mauritiana subsp. orthacantha	(DC.) A.Chev.	Rev. Bot. Appl. Agric. Trop. 32: 576 1952
Ziziphus mauritiana var. orthacantha	(DC.) A.Chev.	Rev. Bot. Appl. Agric. Trop. 27: 477 1947
Ziziphus mauritiana var. deserticola	A.Chev.	Rev. Bot. Appl. Agric. Trop. 27: 477 1947
Ziziphus vulgaris var. spinosa	Bunge	Enum. Pl. China Bor. : 14 (1833)
Ziziphus acidojujuba f. granulata	C.Y.Cheng & M.J.Liu	J. Hebei Agric. Univ. 17(4): 5 (1994)
Ziziphus acidojujuba f. trachysperma	C.Y.Cheng & M.J.Liu	J. Hebei Agric. Univ. 17(4): 5 (1994)
Ziziphus jujuba f. carnosicalycis	C.Y.Cheng & M.J.Liu	J. Hebei Agric. Univ. 17(4): 8 (1994)
Ziziphus jujuba f. apyrena	C.Y.Cheng & M.J.Liu	J. Hebei Agric. Univ. 17(4): 8 (1994)

Common names Top

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Filter by language:

Language	Common/alternative name
English	jujube
English	chinese jujube
Spanish	azufaifo
Arabic	سدر جبلي
Arabic	عناب
Arabic	نبق
Arabic	زيزف جوجوبا
Assamese	বগৰী
Azerbaijani	Əsl innab
Bulgarian	хинап
Tibetan	འབྲ་གོ་དམར་པོ།
Catalan	ginjoler
cdo	cō̤
Czech	cicimek datlový
Czech	cicimek čínský
Danish	almindelig jujube
dag	zuŋguli kukua
German	chinesische jujube
dv	ކުންނާރު
Greek	Τζιτζιφιά
Esperanto	jujubarbo
Estonian	harilik kreektürn
Basque	jujubondo
Persian	عناب
Finnish	jujuba
Finnish	kiinanjujuba
French	jujubier commun
Irish	sisiúb
Galician	azofeifeira
Gujarati	બોર
Hebrew	שיזף סיני
Croatian	žižula
Croatian	Žižula
Hungarian	kínai datolya
Hungarian	ziziphus zizyphus
Hungarian	jujuba
Armenian	Ունաբ սովորական
Indonesian	angco
Indonesian	apel india
Indonesian	bidara
Indonesian	bidara cina
Indonesian	futsa
Indonesian	jujube
Indonesian	putsa
io	jujubo
Italian	giuggiolo
Japanese	ナツメ
Kazakh	Кәдімгі шилен
Kannada	ಎಲಚಿ
Korean	대추
Korean	대추나무
kv	Унаби
lij	zizoa
lmo	ziziphus zizyphus
Latvian	zizifs
lzh	棗
Malayalam	ഇലന്ത
Marathi	बोर
Malay	jujube
Burmese	ဆီးပင်
Norwegian Bokmål	kinajujube
Dutch	chinese jujube
oc	ginjorlièr
Oriya	ବର କୋଳି
Polish	głożyna pospolita
Pashto	مرخڼی
Portuguese	jujuba
Romanian	Măslin dobrogean
Russian	Зизифус настоящий
Russian	Китайский финик
Russian	Унаби обыкновенная
Russian	Ююба китайская
sat	ᱡᱟᱹᱱᱩᱢ
scn	nzìnzula
sco	jujube
Serbo-Croatian	Žižula
Slovak	jujuba holá
Slovenian	Žižola
Slovenian	navadni čičimak
Slovenian	čičimak
Slovenian	žižola
Albanian	xinxifja
Serbian	jујуба
su	bidara
Swedish	jujubär
Tamil	இலந்தை
Thai	พุทราจีน
Turkish	hünnap
Uzbek	yovvoyi chilonjiyda
Vietnamese	táo tàu
za	makcaujcij
Chinese	枣
Chinese	大枣
Chinese	枣叶
Chinese	枣树
Chinese	枣树根
Chinese	枣树皮
Chinese	枣核
Chinese	酸枣仁
Chinese	棗
Chinese	龙爪枣
Chinese	枣樹

Subspecies (abbr. subsp./ssp.) Top

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Varieties (abbr. var.) Top

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Name	Authority	First published in
Ziziphus jujuba var. inermis	(Bunge) Rehder	J. Arnold Arbor. 3: 220 1922
Ziziphus jujuba var. spinosa	(Bunge) Hu ex H.F.Chow	Familiar Trees Hopei 307 1934

Subvarieties (abbr. subvar.) Top

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Forms (abbr. f.) Top

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Name	Authority	First published in
Ziziphus jujuba f. lageniformis	(Nakai) Kitag.	Lin. Fl. Manshur. 313 1939

Germination/Propagation Top

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Distribution (via POWO/KEW) Top

Legend for the distribution data:

- Doubtful data

- Extinct

- Introduced

- Native

Africa click to expand
- Northern Africa
  - Algeria
  - Libya
  - Morocco
  - Tunisia
- West Tropical Africa
  - Burkina
- West-central Tropical Africa
  - Cameroon

Asia-temperate click to expand
- China
  - China North-central
  - China South-central
  - China Southeast
  - Inner Mongolia
  - Manchuria
  - Xinjiang
- Eastern Asia
  - Japan
  - Korea
- Middle Asia
  - Kazakhstan
  - Kirgizstan
  - Tadzhikistan
  - Turkmenistan
  - Uzbekistan
- Western Asia
  - Afghanistan
  - Cyprus
  - Iran
  - Iraq
  - Lebanon-Syria
  - Turkey

Asia-tropical click to expand
- Indian Subcontinent
  - Assam
  - India
  - Maldives
  - Pakistan
  - West Himalaya
- Indo-China
  - Laos

Europe click to expand
- Southeastern Europe
  - Bulgaria
  - Greece
  - Italy
  - Kriti
  - Romania
  - Sicilia
  - Turkey-in-Europe
  - Yugoslavia
- Southwestern Europe
  - France
  - Spain

Northern America click to expand
- South-central U.S.A.
  - Texas
- Southeastern U.S.A.
  - Alabama
  - Florida
  - Georgia
  - Louisiana
- Southwestern U.S.A.
  - Arizona
  - California
  - Utah

Southern America click to expand
- Caribbean
  - Cuba
  - Dominican Republic
  - Jamaica
  - Venezuelan Antilles
- Central America
  - Honduras
- Northern South America
  - Venezuela

Links to other databases Top

Suggest others/fix!

Database	ID/link to page
World Flora Online	wfo-0000430303
UNII	AQG914O70P
Florida Plant Atlas	1920
Flora of Alabama	3099
Tropicos	27500858
INPN	162352
Flora of Italy	3062
KEW	urn:lsid:ipni.org:names:719213-1
The Plant List	kew-2470699
Plantarium	41195
Missouri Botanical Garden	286335
PFAF	Ziziphus jujuba
Open Tree Of Life	73483
Observations.org	129847
NCBI Taxonomy	326968
IUCN Red List	63538
IPNI	719213-1
iNaturalist	428365
GBIF	3039423
EPPO	ZIPJU
EOL	582338
Elurikkus	8263
US Library of Congress	sh85070983
USDA GRIN	42282
Wikipedia	Jujube
CMAUP	NPO5986

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
GCF_031755915.1	ASM3175591v1	Complete Genome	Hebei Agricultural University	2023-09-20	70.0x	375.11 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

The complete chloroplast genome sequence of Rhamnella wilsonii Schneid (Rhamnaceae)

Wang G, An J, Si J

Mitochondrial DNA B Resour

12-Apr-2024

PMCID:	PMC11018004
doi:	10.1080/23802359.2024.2339492
PMID:	38623175

Danggui Sini decoction alleviates oxaliplatin-induced peripheral neuropathy by regulating gut microbiota and potentially relieving neuroinflammation related metabolic disorder

Chen C, Xu JL, Gu ZC, Zhou SS, Wei GL, Gu JL, Ma HL, Feng YQ, Song ZW, Yan ZP, Deng S, Ding R, Li SL, Huo JG

Chin Med

07-Apr-2024

PMCID:	PMC10999090
doi:	10.1186/s13020-024-00929-7
PMID:	38584284

Effects of variable-temperature drying on the qualities and sweet-substance profile of Zizyphus jujuba Mill. cv. Junzao

Liao Y, Liu Y, Zhang W, Dong H, Yang L, Zhang J, Wang Y, Cheng S, Chen G

Food Chem X

06-Apr-2024

PMCID:	PMC11021840
doi:	10.1016/j.fochx.2024.101361
PMID:	38633738

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

Beneath the rind: A review on the remarkable health benefits and applications of the wood apple fruit

Sharma N, Radha, Kumar M, Kumari N, Rais N, Pundir A, Anitha T, Balamurugan V, Senapathy M, Dhumal S, Natta S, Deshmukh VP, Kumar S, Pandiselvam R, Lorenzo JM, Mekhemar M

Heliyon

03-Apr-2024

PMCID:	PMC11016700
doi:	10.1016/j.heliyon.2024.e29202
PMID:	38623209

Pest categorisation of Eulecanium giganteum

Bragard C, Baptista P, Chatzivassiliou E, Di Serio F, Gonthier P, Jaques Miret JA, Justesen AF, Magnusson CS, Milonas P, Navas‐Cortes JA, Parnell S, Potting R, Reignault PL, Stefani E, Thulke H, Van der Werf W, Vicent Civera A, Yuen J, Zappalà L, Grégoire J, Malumphy C, Akrivou A, Kertesz V, Papachristos D, Sfyra O, MacLeod A

EFSA J

03-Apr-2024

PMCID:	PMC10988561
doi:	10.2903/j.efsa.2024.8666
PMID:	38576539

Screening candidate genes for fruit size based on QTL-seq in Chinese jujube

Pan Y, Luo Y, Bao J, Wu C, Wang J, Liu M, Yan F

Front Plant Sci

02-Apr-2024

PMCID:	PMC11021866
doi:	10.3389/fpls.2024.1361771
PMID:	38633465

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

In vitro antimicrobial and antibiofilm screening of eighteen Iranian medicinal plants

Hamidi M, Toosi AM, Javadi B, Asili J, Soheili V, Shakeri A

BMC Complement Med Ther

28-Mar-2024

PMCID:	PMC10976835
doi:	10.1186/s12906-024-04437-x
PMID:	38549139

Milk-based culture of Penicillium camemberti and its component oleamide affect cognitive function in healthy elderly Japanese individuals: a multi-arm randomized, double-blind, placebo-controlled study

Sasaki M, Oba C, Nakamura K, Takeo H, Toya H, Furuichi K

Front Nutr

27-Mar-2024

PMCID:	PMC11004446
doi:	10.3389/fnut.2024.1357920
PMID:	38600994

Exploring the potential of Ziziphus nummularia and luteolin-7-O-glucoside as tubulin inhibitors in cancer therapy and survival

Alghamdi SS, Alghashem SA, Ali R, Alsubait A, Suliman RS, Mohammed AE, Alehaideb Z, Alshafi RA, Alturki AY, Rahman I

Sci Rep

26-Mar-2024

PMCID:	PMC10966015
doi:	10.1038/s41598-024-57680-0
PMID:	38531974

Identification and functional analysis of the LEAFY gene in longan flower induction

Jue D, Li Z, Zhang W, Tang J, Xie T, Sang X, Guo Q

BMC Genomics

25-Mar-2024

PMCID:	PMC10962150
doi:	10.1186/s12864-024-10229-x
PMID:	38528464

Identification and Expression Analysis of Putative Sugar Transporter Gene Family during Bulb Formation in Lilies

Huang Z, Gao C, Xu Y, Liu J, Kang J, Ren Z, Cui Q, Li D, Ma S, Xia Y, Wu Y

Int J Mol Sci

20-Mar-2024

PMCID:	PMC10970775
doi:	10.3390/ijms25063483
PMID:	38542476

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

Serratia spp. as plant growth-promoting bacteria alleviating salinity, drought, and nutrient imbalance stresses

Kulkova I, Wróbel B, Dobrzyński J

Front Microbiol

18-Mar-2024

PMCID:	PMC10982427
doi:	10.3389/fmicb.2024.1342331
PMID:	38562478

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 / Aporphines
(-)-Caaverine	23335	Click to see COC1=C(C2=C3C(CC4=CC=CC=C42)NCCC3=C1)O	267.32	unknown	https://doi.org/10.1007/BF02911058 https://doi.org/10.1007/BF02857740
(+)-Asimilobine	25774982	Click to see COC1=C(C=C2CCNC3C2=C1C4=CC=CC=C4C3)O	267.32	unknown	via CMAUP database
Asimilobine	160875	Click to see COC1=C(C=C2CCNC3C2=C1C4=CC=CC=C4C3)O	267.32	unknown	via CMAUP database
Lysicamine	122691	Click to see COC1=C(C2=C3C(=C1)C=CN=C3C(=O)C4=CC=CC=C42)OC	291.30	unknown	https://doi.org/10.1007/BF02857741
Magnoflorine	73337	Click to see C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)O)OC)C	342.40	unknown	https://doi.org/10.1248/CPB.45.1186
N-Nornuciferine	12313579	Click to see COC1=C(C2=C3C(CC4=CC=CC=C42)NCCC3=C1)OC	281.30	unknown	via CMAUP database
Nornuciferine	41169	Click to see COC1=C(C2=C3C(CC4=CC=CC=C42)NCCC3=C1)OC	281.30	unknown	https://doi.org/10.1007/BF02857741 https://doi.org/10.1007/BF02911058
Nuciferine	10146	Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC=CC=C43)OC)OC	295.40	unknown	https://doi.org/10.1007/BF02857740 https://doi.org/10.1007/BF02911058
O-Nornuciferine	197017	Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC=CC=C43)OC)O	281.30	unknown	https://doi.org/10.1007/BF02857740 https://doi.org/10.1007/BF02911058
Zizyphusine	102063083	Click to see C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)OC)O)O)C	342.40	unknown	https://doi.org/10.1007/BF02911058 https://doi.org/10.1007/BF02857741 https://doi.org/10.1007/BF02857740
> Alkaloids and derivatives / Plumeran-type alkaloids
methyl (4S)-4-[(10S,11R)-11-acetyloxy-12-ethyl-10-hydroxy-5-methoxy-10-methoxycarbonyl-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraen-4-yl]-1-ethyl-2-oxa-6,16-diazahexacyclo[16.2.1.03,19.05,13.07,12.016,19]henicosa-5(13),7,9,11-tetraene-4-carboxylate	5315743	Click to see CCC12CC3CN4C3(C1)C(O2)C(C5=C(CC4)C6=CC=CC=C6N5)(C7=C(C=C8C(=C7)C91CCN2C9C(C=CC2)(C(C(C1N8C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC	821.00	unknown	via CMAUP database
> Alkaloids and derivatives / Proaporphines
(4S)-10,11-dimethoxyspiro[5-azatricyclo[6.3.1.04,12]dodeca-1(12),8,10-triene-2,4'-cyclohexa-2,5-diene]-1'-one	830726	Click to see COC1=C(C2=C3C(CC24C=CC(=O)C=C4)NCCC3=C1)OC	297.30	unknown	via CMAUP database
> Alkaloids and derivatives / Protoberberine alkaloids and derivatives
16,17-Dimethoxy-6-tritio-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene	10246509	Click to see COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC	338.40	unknown	via CMAUP database
l-Stepholidine	6917970	Click to see COC1=C(C=C2C3CC4=C(CN3CCC2=C1)C(=C(C=C4)O)OC)O	327.40	unknown	via CMAUP database
> Alkaloids and derivatives / Protopine alkaloids
Pseudoprotopine	185559	Click to see CN1CCC2=CC3=C(C=C2C(=O)CC4=CC5=C(C=C4C1)OCO5)OCO3	353.40	unknown	via CMAUP database
> Alkaloids and derivatives / Strychnos alkaloids
Scholaricine	50900051	Click to see CC(C1CN2CCC34C2CC1C(=C3NC5=C4C=CC=C5O)C(=O)OC)O	356.40	unknown	https://doi.org/10.3987/COM-88-4578
> Benzenoids / Benzene and substituted derivatives
Benzaldehyde, oxime, (Z)-	5324470	Click to see C1=CC=C(C=C1)C=NO	121.14	unknown	via CMAUP database
Dodecylbenzene	31237	Click to see CCCCCCCCCCCCC1=CC=CC=C1	246.40	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Acetophenones
[(2R,3S)-5-acetyl-6-methoxy-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-3-yl] (Z)-2-methylbut-2-enoate	163186281	Click to see CC=C(C)C(=O)OC1C(OC2=CC(=C(C=C12)C(=O)C)OC)C(=C)C	330.40	unknown	https://doi.org/10.1016/S0031-9422(00)85072-4
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives
3,4-Dihydroxybenzoic acid	72	Click to see C1=CC(=C(C=C1C(=O)O)O)O	154.12	unknown	https://doi.org/10.1016/J.BSE.2013.04.001
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
Syringic acid	10742	Click to see COC1=CC(=CC(=C1O)OC)C(=O)O	198.17	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 / Benzoyl derivatives
Benzaldehyde	240	Click to see C1=CC=C(C=C1)C=O	106.12	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzyloxycarbonyls
Benzyl acetate	8785	Click to see CC(=O)OCC1=CC=CC=C1	150.17	unknown	via CMAUP database
> Benzenoids / Phenols / 1-hydroxy-2-unsubstituted benzenoids
4-Allylphenol	68148	Click to see C=CCC1=CC=C(C=C1)O	134.17	unknown	via CMAUP database
> Benzenoids / Phenols / Benzenediols / Catechols
Catechol	289	Click to see C1=CC=C(C(=C1)O)O	110.11	unknown	via CMAUP database
Catechol,[14c(u)]	11480435	Click to see C1=CC=C(C(=C1)O)O	122.07	unknown	via CMAUP database
> Benzenoids / Phenols / Methoxyphenols
4-[(E)-3-hydroxyprop-1-enyl]-2,6-bis(trideuteriomethoxy)phenol	10703933	Click to see COC1=CC(=CC(=C1O)OC)C=CCO	216.26	unknown	via CMAUP database
cis-Isoeugenol	1549041	Click to see CC=CC1=CC(=C(C=C1)O)OC	164.20	unknown	via CMAUP database
Eugenol	3314	Click to see COC1=C(C=CC(=C1)CC=C)O	164.20	unknown	via CMAUP database
Isoeugenol	853433	Click to see CC=CC1=CC(=C(C=C1)O)OC	164.20	unknown	via CMAUP database
N-Trans-feruloyltramine	5280537	Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)O	313.30	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Acyl carnitines
Heptadecanoyl carnitine	53477803	Click to see CCCCCCCCCCCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C	413.60	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
(9Z)-12-hydroxyoctadec-9-enoic acid	5282942	Click to see CCCCCCC(CC=CCCCCCCCC(=O)O)O	298.50	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
2-Dodecyl-3-methylbutanedioic acid	99891	Click to see CCCCCCCCCCCCC(C(C)C(=O)O)C(=O)O	300.40	unknown	via CMAUP database
9-Eicosenoic acid	5460988	Click to see CCCCCCCCCCC=CCCCCCCCC(=O)O	310.50	unknown	via CMAUP database
9-Hexadecenoic acid	5282745	Click to see CCCCCCC=CCCCCCCCC(=O)O	254.41	unknown	via CMAUP database
9-Octadecenoic acid	965	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	282.50	unknown	via CMAUP database
Arachidic Acid	10467	Click to see CCCCCCCCCCCCCCCCCCCC(=O)O	312.50	unknown	via CMAUP database
Elaidic Acid	637517	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	282.50	unknown	via CMAUP database
Gadoleic Acid	5282767	Click to see CCCCCCCCCCC=CCCCCCCCC(=O)O	310.50	unknown	via CMAUP database
Icos-9-enoic acid	94159	Click to see CCCCCCCCCCC=CCCCCCCCC(=O)O	310.50	unknown	via CMAUP database
Myristic Acid	11005	Click to see CCCCCCCCCCCCCC(=O)O	228.37	unknown	via CMAUP database
Myristoleic acid	5281119	Click to see CCCCC=CCCCCCCCC(=O)O	226.35	unknown	via CMAUP database
Oleic Acid	445639	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	282.50	unknown	https://doi.org/10.1055/S-2002-36354
Palmitic Acid	985	Click to see CCCCCCCCCCCCCCCC(=O)O	256.42	unknown	via CMAUP database
Palmitoleic Acid	445638	Click to see CCCCCCC=CCCCCCCCC(=O)O	254.41	unknown	via CMAUP database
Stearic Acid	5281	Click to see CCCCCCCCCCCCCCCCCC(=O)O	284.50	unknown	https://doi.org/10.1055/S-2002-36354 https://doi.org/10.1007/978-3-642-48618-0_9
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids
Caproic Acid	8892	Click to see CCCCCC(=O)O	116.16	unknown	via CMAUP database
Heptanoic Acid	8094	Click to see CCCCCCC(=O)O	130.18	unknown	via CMAUP database
Lauric Acid	3893	Click to see CCCCCCCCCCCC(=O)O	200.32	unknown	via CMAUP database
Octanoic acid	379	Click to see CCCCCCCC(=O)O	144.21	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
Tetracosanoate	5461021	Click to see CCCCCCCCCCCCCCCCCCCCCCCC(=O)[O-]	367.60	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides
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 / Lineolic acids and derivatives
9,12-Octadecadienoic acid	3931	Click to see CCCCCC=CCC=CCCCCCCCC(=O)O	280.40	unknown	via CMAUP database
9,12-Octadecadienoic acid, (E,Z)-	5282798	Click to see CCCCCC=CCC=CCCCCCCCC(=O)O	280.40	unknown	via CMAUP database
9Z,12E-octadecadienoic acid	5282797	Click to see CCCCCC=CCC=CCCCCCCCC(=O)O	280.40	unknown	via CMAUP database
Linoelaidic acid	5282457	Click to see CCCCCC=CCC=CCCCCCCCC(=O)O	280.40	unknown	via CMAUP database
Linoleic Acid	5280450	Click to see CCCCCC=CCC=CCCCCCCCC(=O)O	280.40	unknown	https://doi.org/10.1055/S-2002-36354
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 / Tigliane and ingenane diterpenoids
[(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
(16S)-16-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.01,8.05,17.07,16.09,14.014,18]nonadecan-19-one	5321444	Click to see CC12CCCC34C1C5(CC67C3C(=O)C(CC6C4N5C2)C(=C)C7)O	311.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Monocyclic monoterpenoids
Cyclohexene, 1-methyl-3-(1-methylethenyl)-	10354	Click to see CC1=CC(CCC1)C(=C)C	136.23	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Vitamin E compounds / Tocopherols
Alpha-Tocopherol	14985	Click to see CC1=C(C2=C(CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C)C(=C1O)C)C	430.70	unknown	via CMAUP database
DL-alpha-Tocopherol	2116	Click to see CC1=C(C2=C(CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C)C(=C1O)C)C	430.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
(+)-beta-Caryophyllene	20831623	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
(4Z)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene	5322111	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
(6R,9S)-vomifoliol	11816951	Click to see CC1=CC(=O)CC(C1(C=CC(C)O)O)(C)C	224.30	unknown	via CMAUP database
(E)-alpha-bisabolene	5315468	Click to see CC1=CCC(CC1)C(=CCC=C(C)C)C	204.35	unknown	https://doi.org/10.1007/BF00597721
(R)-beta-bisabolene	68128	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	https://doi.org/10.1007/BF00597721
(Z)-alpha-Bisabolene	5352653	Click to see CC1=CCC(CC1)C(=CCC=C(C)C)C	204.35	unknown	https://doi.org/10.1007/BF00597721
(Z)-caryophyllene	6429301	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
[4,5-Dihydroxy-2-(9-hydroxy-3,7,11-trimethyldodeca-1,6,10-trien-3-yl)oxyoxan-3-yl] acetate	162940973	Click to see CC(=CC(CC(=CCCC(C)(C=C)OC1C(C(C(CO1)O)O)OC(=O)C)C)O)C	412.50	unknown	https://doi.org/10.1016/S0031-9422(00)85004-9
4,11,11-Trimethyl-8-methylene-5-oxatricyclo(8.2.0.0(4,6))dodecane, (1R,4R,6R,10S)-	6604672	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
beta-Bisabolene	10104370	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	https://doi.org/10.1007/BF00597721
beta-CARYOPHYLLENE OXIDE	1742210	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
Caryophyllene	5281515	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
Caryophyllene epoxide	14350	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
Caryophyllene oxide 2	13240188	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
Caryophyllene,alpha + beta mixt.	5354499	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
delta-Cadinene	12306054	Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C	204.35	unknown	via CMAUP database
Humulene	5281520	Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C	204.35	unknown	via CMAUP database
Isocaryophyllene	5281522	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
Isocaryophyllene oxide	1742211	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-7-methyl-4-methylene-1-(1-methylethyl)-, (1alpha,4aalpha,8aalpha)-	6432308	Click to see CC1=CC2C(CC1)C(=C)CCC2C(C)C	204.35	unknown	via CMAUP database
Naphthalene, 1,2,3,5,6,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, (1S-cis)-	12306059	Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C	204.35	unknown	via CMAUP database
trans-Z-alpha-Bisabolene epoxide	5363099	Click to see CC(=CCC=C(C)C1CCC2(C(C1)O2)C)C	220.35	unknown	via CMAUP database
Tumerone	558173	Click to see CC1=CC=C(CC1)C(C)CC(=O)C=C(C)C	218.33	unknown	via CMAUP database
Vomifoliol	5280462	Click to see CC1=CC(=O)CC(C1(C=CC(C)O)O)(C)C	224.30	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Agarofurans
[(1R,2S,5R,6R,7R,9R)-7-acetyloxy-5-hydroxy-6-(hydroxymethyl)-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-8-yl] benzoate	6325577	Click to see CC1CCC(C2(C13CC(C(C2OC(=O)C)OC(=O)C4=CC=CC=C4)C(O3)(C)C)CO)O	432.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids
(-)-Ledol	6431133	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
(+)-Ledol	11074994	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, [1ar-(1aalpha,4alpha,4abeta,7alpha,7abeta,7balpha)]-	6432561	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
Globulol	101716	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
Ledol	92812	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
Ledum camphor	22297324	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Diterpene glycosides / Steviol glycosides
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1S,4R,5R,9R,10S,13R)-13-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate	23621216	Click to see CC12CCCC(C1CCC34C2CCC(C3)(C(=C)C4)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)(C)C(=O)OC7C(C(C(C(O7)CO)O)O)O	804.90	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Iridoid O-glycosides
methyl (1S,4aS,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate	10842393	Click to see COC(=O)C1=COC(C2C1CC=C2CO)OC3C(C(C(C(O3)COC4C(C(C(C(O4)COC(=O)C=CC5=CC=C(C=C5)O)O)O)O)O)O)O	696.60	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
Protojujuboside B	71448944	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C(C(=O)CC6(C5(CCC4C3(C)C)C)CO)C(C)(CC(C=C(C)C)OC7C(C(C(C(O7)CO)O)O)O)O)C)O)OC8C(C(C(C(O8)CO)O)O)OC9C(C(C(CO9)O)O)O)O)O)O	1225.40	unknown	https://doi.org/10.1248/CPB.47.1744
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
(4aR,5R,9aR)-9a-hydroxy-3,4a,5-trimethyl-4,5-dihydrobenzo[f][1]benzofuran-2,6-dione	163049634	Click to see CC1C(=O)C=CC2=CC3(C(=C(C(=O)O3)C)CC12C)O	260.28	unknown	https://doi.org/10.1016/S0031-9422(00)88967-0
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Eudesmanolides, secoeudesmanolides, and derivatives
Vulgarin	94253	Click to see CC1C2CCC3(C(C2OC1=O)C(C=CC3=O)(C)O)C	264.32	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Carotenes
Beta-Carotene	5280489	Click to see CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C)C)C	536.90	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(10R)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid	45358157	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O	456.70	unknown	via CMAUP database
(1R,2R,5S,8R,14R,15S,16R,18R)-15-formyl-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5-carboxylic acid	15958447	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)O)C=O)C)C)C(=O)O	470.70	unknown	via CMAUP database
(1R,2R,5S,8R,9R,10R,13R,14R,15S,16S,18R)-15-formyl-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5-carboxylic acid	54582219	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)O)C=O)C)C)C(=O)O	470.70	unknown	via CMAUP database
(1R,2R,5S,8R,9R,10R,13S,14S,18S)-15-formyl-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icos-15-ene-5-carboxylic acid	101936049	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(=CC5(C)C)C=O)C)C)C(=O)O	452.70	unknown	via CMAUP database
(1R,3aS,5aR,5bR,7aR,9R,11aR,11bR,13aS,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid	11897956	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O	456.70	unknown	via CMAUP database
(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13bR)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-1H-cyclopenta[a]chrysen-9-ol	51340201	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)CO	442.70	unknown	via CMAUP database
(1R,3aS,5aR,5bR,9R,10R,11aR)-9,10-dihydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid	51025490	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)C)O)O)C)C)C(=O)O	472.70	unknown	via CMAUP database
(1R,3aS,5aS,5bR,9R,10R,11aR)-9,10-dihydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13b-tetradecahydrocyclopenta[a]chrysene-3a-carboxylic acid	470606	Click to see CC(=C)C1CCC2(C1C3=CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)C)O)O)C)C)C(=O)O	470.70	unknown	https://doi.org/10.1248/CPB.26.3075
(1R,5aR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid	45358111	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O	456.70	unknown	via CMAUP database
(1S,2R,4aR,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid	45483617	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O	456.70	unknown	via CMAUP database
(1S,2R,4aS,6aS,6bR,10R,11R,12aR)-10,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid	470602	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)O	472.70	unknown	via CMAUP database
(2alpha,3beta)-2-[(3,4-Dihydroxybenzoyl)oxy]-3-hydroxylup-20(29)-en-28-oic acid	102247122	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)C)O)OC(=O)C6=CC(=C(C=C6)O)O)C)C)C(=O)O	608.80	unknown	https://doi.org/10.1016/0031-9422(96)00379-2
(2R,3R,4S,5R,6R)-2-[(2S,3R,4S,5S)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(2R,5R,7S,10R,11R,14R,15S,16S,18R,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	177396	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1207.30	unknown	via CMAUP database
(2R,7S,10R)-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosane-7,16-diol	5318721	Click to see CC(=CC1CC(C2C3CCC4C5(CCC(C(C5CCC4(C36CC2(O1)OC6)C)(C)C)O)C)(C)O)C	472.70	unknown	via CMAUP database
(2R)-2-[(2R)-4-[(2R)-4,5-dihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,10R,11R,14S,15R,16S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	138114261	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1207.30	unknown	https://doi.org/10.1007/978-3-642-48618-0_9 https://doi.org/10.1248/CPB.45.1186
(2R)-2-[(2S)-4-[(2S)-4,5-dihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,10R,11R,14R,15S,16S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	138114804	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1207.30	unknown	https://doi.org/10.1007/978-3-642-48618-0_9
(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[[(1S,2R,10R,11R,16R,18R,20R,22S)-18-(2-hydroxypropan-2-yl)-2,6,6,10,16-pentamethyl-17,21,23-trioxaheptacyclo[20.2.1.01,14.02,11.05,10.015,22.016,20]pentacosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	10079038	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C5CCC6C7C8(C(CC(O8)C(C)(C)O)OC79CC6(C5(CCC4C3(C)C)C)CO9)C)C)CO)O)O)O)O)O	797.00	unknown	via CMAUP database
(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[[(1S,2R,5R,10R,11R,14R,15S,16R,18R,20R,22S)-18-(2-hydroxypropan-2-yl)-2,6,6,10,16-pentamethyl-17,21,23-trioxaheptacyclo[20.2.1.01,14.02,11.05,10.015,22.016,20]pentacosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	101635354	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C5CCC6C7C8(C(CC(O8)C(C)(C)O)OC79CC6(C5(CCC4C3(C)C)C)CO9)C)C)CO)O)O)O)O)O	797.00	unknown	https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275
(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[[18-(2-hydroxypropan-2-yl)-2,6,6,10,16-pentamethyl-17,21,23-trioxaheptacyclo[20.2.1.01,14.02,11.05,10.015,22.016,20]pentacosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	5318720	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C5CCC6C7C8(C(CC(O8)C(C)(C)O)OC79CC6(C5(CCC4C3(C)C)C)CO9)C)C)CO)O)O)O)O)O	797.00	unknown	https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275
(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-[[16-hydroxy-2,6,6,10,16-pentamethyl-17-(3-methylbut-2-enyl)-18,20-dioxahexacyclo[17.2.1.01,14.02,11.05,10.015,19]docosan-7-yl]oxy]-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol	5318719	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C5CCC6C7C(C(OC78CC6(C5(CCC4C3(C)C)C)CO8)CC=C(C)C)(C)O)C)CO)O)OC9C(C(C(C(O9)CO)O)O)O)O)O)O	943.10	unknown	https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275
(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-2-[[(1S,2R,10R,11R,16R,19S)-16-hydroxy-2,6,6,10,16-pentamethyl-17-(3-methylbut-2-enyl)-18,20-dioxahexacyclo[17.2.1.01,14.02,11.05,10.015,19]docosan-7-yl]oxy]-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol	10418389	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C5CCC6C7C(C(OC78CC6(C5(CCC4C3(C)C)C)CO8)CC=C(C)C)(C)O)C)CO)O)OC9C(C(C(C(O9)CO)O)O)O)O)O)O	943.10	unknown	via CMAUP database
(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-2-[[(1S,2R,5R,10R,11R,14R,15S,16R,17S,19S)-16-hydroxy-2,6,6,10,16-pentamethyl-17-(3-methylbut-2-enyl)-18,20-dioxahexacyclo[17.2.1.01,14.02,11.05,10.015,19]docosan-7-yl]oxy]-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol	101635352	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C5CCC6C7C(C(OC78CC6(C5(CCC4C3(C)C)C)CO8)CC=C(C)C)(C)O)C)CO)O)OC9C(C(C(C(O9)CO)O)O)O)O)O)O	943.10	unknown	https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275
(2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5R)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-5-hydroxy-2-[[16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	11968657	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(C(O1)CO)O)O)O)O)O)O	1237.40	unknown	via CMAUP database
(2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5S)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,7S,10R,11R,14R,15S,16S,18S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	102004533	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1207.30	unknown	via CMAUP database
(2S,3R,4R,5R,6S)-2-[(3R,4S,5S)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(2R,5R,7S,10R,11R,14R,15S,16S,18R,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	171446	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1207.30	unknown	via CMAUP database
(2S,3R,4S,5S)-2-[(2S,3R,4S,5R)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	11968656	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1207.30	unknown	via CMAUP database
(2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5S)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,7S,10R,11R,14R,15S,16S,18S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	102004531	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1207.30	unknown	via CMAUP database
(3beta,16beta,23R)-16,23:16,30-Diepoxy-20-hydroxydammar-24-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-->2)-O-[O-beta-D-xylopyranosyl-(1-->2)-6-O-acetyl-beta-D-glucopyranosyl-(1-->3)]-alpha-L-arabinopyranoside	101709345	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC(=O)C)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1087.20	unknown	https://doi.org/10.1248/CPB.47.1744 https://doi.org/10.1248/CPB.45.1186
(3R,4S,5R,6R)-2-[(3R,4S,5S)-4-[(3R,4S,5S,6R)-4,5-dihydroxy-6-[[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(2R,5R,7S,10R,11R,14R,15S,16S,18R,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	71571444	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1207.30	unknown	via CMAUP database
(4aR,6aR,6aS,6bR,8aR,10S,12aR,14bS)-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	45483610	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
(4aS,6aS,6aS,6bR,8aR,10R,11R,12aR,14bS)-10,11-dihydroxy-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	11887403	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C	472.70	unknown	via CMAUP database
[(2S,3R,4R,5S,6S)-3-acetyloxy-2-[[(1S,2R,5R,7S,10R,11R,15S,16S,18R,20S)-7-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-16-yl]oxy]-5-hydroxy-6-methyloxan-4-yl] acetate	118701286	Click to see CC1C(C(C(C(O1)OC2COC(C(C2O)O)OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)OC9C(C(C(C(O9)C)O)OC(=O)C)OC(=O)C)C)O)O)O	981.20	unknown	https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1016/S0040-4020(01)85093-6 https://doi.org/10.1016/0040-4039(91)85039-8
2-[[3-[3,5-dihydroxy-6-(hydroxymethyl)-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxymethyl]-6-[4,5-dihydroxy-2-[[(1S,2R,7S,10R,11R,14R,15S,16S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]-6-methyloxan-3-yl]oxyoxane-3,4,5-triol	11970115	Click to see CC1C(C(C(C(O1)OC2CCC3(C4CCC5C6C(CC(OC67CC5(C4(CCC3C2(C)C)C)CO7)C=C(C)C)(C)O)C)OC8C(C(C(C(O8)COC9C(C(C(CO9)O)O)OC1C(C(C(C(O1)CO)O)OC1C(C(C(CO1)O)O)O)O)O)O)O)O)O	1207.30	unknown	https://doi.org/10.1248/CPB.45.1186
2-[2-[2-[4,5-dihydroxy-2-[[(1S,2R,7S,10R,11R,14R,15S,16S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]-6-methyloxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxyoxane-3,4,5-triol	11970116	Click to see CC1C(C(C(C(O1)OC2CCC3(C4CCC5C6C(CC(OC67CC5(C4(CCC3C2(C)C)C)CO7)C=C(C)C)(C)O)C)OC8C(C(C(CO8)O)O)OC9C(C(C(C(O9)CO)O)OC1C(C(C(CO1)O)O)O)O)O)O	1045.20	unknown	https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.45.1186 https://doi.org/10.1248/CPB.40.2275 https://doi.org/10.1021/NP50013A016
2-[4-[4,5-Dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-5-hydroxy-2-[[16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol	73110002	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(C(O1)CO)O)O)O)O)O)O	1237.40	unknown	https://doi.org/10.1248/CPB.47.1744 https://doi.org/10.1248/CPB.45.1186
3-beta-O-(cis-p-Coumaroyl)maslinic acid	101001054	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)OC(=O)C=CC6=CC=C(C=C6)O)O)C)C)C2C1)C)C(=O)O)C	618.80	unknown	via CMAUP database
3-Hydroxyolean-12-en-28-oic acid	619166	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	https://doi.org/10.1007/S10600-011-9859-7
3-O-Protocatechuoylceanothic acid	85245649	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)OC(=O)C6=CC(=C(C=C6)O)O)C(=O)O)C)C)C(=O)O	622.80	unknown	https://doi.org/10.1016/0031-9422(96)00379-2
3-Oxopomolic acid	12314450	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1(C)O)C)C(=O)O	470.70	unknown	via CMAUP database
9-Hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid	2371	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O	456.70	unknown	https://doi.org/10.1007/S10600-011-9859-7
9,10-Dihydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid	12305767	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)C)O)O)C)C)C(=O)O	472.70	unknown	https://doi.org/10.1007/S10600-011-9859-7
Alphitolic acid	12305768	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)C)O)O)C)C)C(=O)O	472.70	unknown	https://doi.org/10.1007/S10600-011-9859-7 https://doi.org/10.1248/CPB.26.3075
beta-Ursolic acid	220774	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O	456.70	unknown	https://doi.org/10.1007/S10600-011-9859-7
Betulin	72326	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)CO	442.70	unknown	https://doi.org/10.1055/S-2007-969308 https://doi.org/10.1111/J.1744-7909.2005.00060.X
Betulinic Acid	64971	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O	456.70	unknown	https://doi.org/10.1055/S-2002-36354 https://doi.org/10.1055/S-2007-969308 https://doi.org/10.1007/S10600-011-9859-7 https://doi.org/10.1111/J.1744-7909.2005.00060.X https://doi.org/10.1007/978-3-642-48618-0_9
Betulonic acid	122844	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(=O)C(C5CCC4(C3(CC2)C)C)(C)C)C)C(=O)O	454.70	unknown	https://doi.org/10.1248/CPB.26.3075
Ceanothenic Acid	71451218	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C(=O)O)(CCC5C4(C=CC5(C)C)C)C)C(=O)O	454.60	unknown	via CMAUP database
Ceanothic acid	161352	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)O)C(=O)O)C)C)C(=O)O	486.70	unknown	https://doi.org/10.1007/S10600-011-9859-7 https://doi.org/10.1111/J.1744-7909.2005.00060.X
Colubrinic acid	21672700	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)O)C=O)C)C)C(=O)O	470.70	unknown	via CMAUP database
Corosolic acid	6918774	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)O	472.70	unknown	https://doi.org/10.1111/J.1744-7909.2005.00060.X
Emmolic acid	578549	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)O)C(=O)O)C)C)C(=O)O	486.70	unknown	https://doi.org/10.1007/S10600-011-9859-7
Epiceanothic Acid	23631167	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)O)C(=O)O)C)C)C(=O)O	486.70	unknown	via CMAUP database
Jujubasaponin V	101635353	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C5CCC6C7C(C(OC78CC6(C5(CCC4C3(C)C)C)CO8)CC=C(C)C)(C)O)C)CO)O)OC9C(C(C(C(O9)CO)O)O)O)O)O)O	943.10	unknown	https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275
Jujuboside A	51346169	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1207.30	unknown	via CMAUP database
Jujuboside A1	53399223	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1207.30	unknown	via CMAUP database
Jujuboside B	24721031	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)CO)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1045.20	unknown	https://doi.org/10.1007/978-3-642-48618-0_9 https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275 https://doi.org/10.1248/CPB.45.1186 https://doi.org/10.1021/NP50013A016
Jujuboside D	92043344	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1207.30	unknown	via CMAUP database
Jujuboside-B	45358134	Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C(C5(CCC4C3(C)C)C)CC78C6C(CC(O7)(OC8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)CO)O)O)OC1C(C(C(CO1)O)O)O)O)O)O	1045.20	unknown	via CMAUP database
Lotoside I	102066551	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C5CCC6C7C(C(OC7(C(C6(C5(CCC4C3(C)C)C)C)O)O)CC=C(C)C)(C)O)C)CO)O)OC8C(C(C(C(O8)CO)O)O)O)O)O)O	961.10	unknown	via CMAUP database
Lotoside II	102066552	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C5CCC6C7C(C(OC7(C(C6(C5(CCC4C3(C)C)C)C)O)O)CC=C(C)C)(C)O)C)CO)O)OC8C(C(C(C(O8)CO)O)O)O)O)O)O	961.10	unknown	via CMAUP database
Maslinic Acid	73659	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C	472.70	unknown	https://doi.org/10.1248/CPB.26.3075
NCGC00168838-03_C30H46O5_(1R,2S,5aR,5bR,7aS,10R,12bR)-2-Hydroxy-10-isopropenyl-3,3,5a,5b,12b-pentamethyloctadecahydrodicyclopenta[a,i]phenanthrene-1,7a(1H)-dicarboxylic acid	10096940	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)O)C(=O)O)C)C)C(=O)O	486.70	unknown	via CMAUP database
Oleanolic Acid	10494	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	https://doi.org/10.1007/S10600-011-9859-7 https://doi.org/10.1055/S-2007-969095
Oleanonic acid	12313704	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1)C)C(=O)O)C	454.70	unknown	https://doi.org/10.1248/CPB.26.3075
Ursolic Acid	64945	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O	456.70	unknown	https://doi.org/10.1111/J.1744-7909.2005.00060.X https://doi.org/10.1007/S10600-011-9859-7 https://doi.org/10.1055/S-2007-969095
Ursonic acid	9890209	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1C)C)C(=O)O	454.70	unknown	via CMAUP database
Ziziphin	441957	Click to see CC1C(C(C(C(O1)OC2COC(C(C2O)O)OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)OC9C(C(C(C(O9)C)O)OC(=O)C)OC(=O)C)C)O)O)O	981.20	unknown	https://doi.org/10.1016/0378-8741(95)01248-C
Zizyberenalic acid	15958448	Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(=CC5(C)C)C=O)C)C)C(=O)O	452.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives
[(3S,8S,10R,12R,13S,14R,17S)-17-acetyl-3,8,14-trihydroxy-10,13-dimethyl-2,3,4,7,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-12-yl] pyridine-3-carboxylate	5320138	Click to see CC(=O)C1CCC2(C1(C(CC3C2(CC=C4C3(CCC(C4)O)C)O)OC(=O)C5=CN=CC=C5)C)O	469.60	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid lactones / Cardenolides and derivatives / Cardenolide glycosides and derivatives
3-[(5R,10R,14S)-3-[(2R,3S,4R,5S,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-14-hydroxy-10-(hydroxymethyl)-13-methyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one	6325934	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)CO)O)OC)O	550.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
(3R,4S,5S,6R)-2-[[(3S,8S,9S,10R,13R,14S)-17-[(2R,5R)-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-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	52940117	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	via CMAUP database
(3R,8R,9R,10S,13R,14R,17R)-17-[(E,2R,5R)-5-ethyl-6-methylhept-3-en-2-yl]-3,10,13-trimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene	50930798	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)C)C)C)C(C)C	410.70	unknown	via CMAUP database
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/10.1055/S-2007-969308
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/10.1055/S-2007-969308 https://doi.org/10.1111/J.1744-7909.2005.00060.X
Stigmasterol glucoside	6602508	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	574.80	unknown	https://doi.org/10.1111/J.1744-7909.2005.00060.X
> 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
9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one	6021	Click to see C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)CO)O)O	268.23	unknown	https://doi.org/10.1007/978-3-642-48618-0_9
Adenosine	60961	Click to see C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N	267.24	unknown	via CMAUP database
> Nucleosides, nucleotides, and analogues / Purine nucleosides / Purine 2-deoxyribonucleosides
2-Deoxyadenosine	636	Click to see C1C(C(OC1N2C=NC3=C(N=CN=C32)N)CO)O	251.24	unknown	via CMAUP database
2'-Deoxyadenosine	13730	Click to see C1C(C(OC1N2C=NC3=C(N=CN=C32)N)CO)O	251.24	unknown	via CMAUP database
> Nucleosides, nucleotides, and analogues / Purine nucleotides / Cyclic purine nucleotides / 3,5-cyclic purine nucleotides
(4aR,6S,7S,7aR)-6-(6-aminopurin-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol	25322948	Click to see C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)O	329.21	unknown	via CMAUP database
2-amino-9-(2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl)-3H-purin-6-one	295	Click to see C1C2C(C(C(O2)N3C=NC4=C3NC(=NC4=O)N)O)OP(=O)(O1)O	345.21	unknown	https://doi.org/10.1016/J.FOODCHEM.2014.07.013
3',5'-cyclic AMP(1-)	7059571	Click to see C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)[O-]	328.20	unknown	via CMAUP database
9-[(4aR,6R,7aR)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-amino-3H-purin-6-one	68331656	Click to see C1C2C(C(C(O2)N3C=NC4=C3NC(=NC4=O)N)O)OP(=O)(O1)O	345.21	unknown	via CMAUP database
9-[(4aR,6R,7R,7aS)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-amino-3H-purin-6-one	24316	Click to see C1C2C(C(C(O2)N3C=NC4=C3NC(=NC4=O)N)O)OP(=O)(O1)O	345.21	unknown	via CMAUP database
9-[(4aR,6S,7R,7aS)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-amino-3H-purin-6-one	73351852	Click to see C1C2C(C(C(O2)N3C=NC4=C3NC(=NC4=O)N)O)OP(=O)(O1)O	345.21	unknown	via CMAUP database
Acrasin	274	Click to see C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)O	329.21	unknown	https://doi.org/10.1016/J.FOODCHEM.2014.07.013
Adenosine cyclic phosphate	6076	Click to see C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)O	329.21	unknown	via CMAUP database
Adenosine cyclophosphate	6714006	Click to see C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)O	329.21	unknown	via CMAUP database
Tocladesine	100299	Click to see C1C2C(C(C(O2)N3C4=NC=NC(=C4N=C3Cl)N)O)OP(=O)(O1)O	363.65	unknown	via CMAUP database
> Nucleosides, nucleotides, and analogues / Pyrimidine nucleosides
Cytidine	6175	Click to see C1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)O	243.22	unknown	via CMAUP database
Uridine	6029	Click to see C1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)O	244.20	unknown	via CMAUP database
> Nucleosides, nucleotides, and analogues / Pyrimidine nucleosides / Pyrimidine 2-deoxyribonucleosides
Thymidine	5789	Click to see CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O	242.23	unknown	via CMAUP database
> Nucleosides, nucleotides, and analogues / Pyrimidine nucleotides / Pyrimidine deoxyribonucleotides / Pyrimidine deoxyribonucleoside monophosphates / Pyrimidine 2-deoxyribonucleoside monophosphates
Deoxycytidine 5'-monophosphate	13945	Click to see C1C(C(OC1N2C=CC(=NC2=O)N)COP(=O)(O)O)O	307.20	unknown	via CMAUP database
> Organic acids and derivatives / Carboximidic acids and derivatives / Carboximidic acids
N-Ethylacetamide	12253	Click to see CCNC(=O)C	87.12	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alanine and derivatives
(2S)-2-(phenylazaniumyl)propanoate	6946449	Click to see CC(C(=O)[O-])[NH2+]C1=CC=CC=C1	165.19	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids
2-Azaniumylhexanoate	517543	Click to see CCCCC(C(=O)[O-])[NH3+]	131.17	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Phenylalanine and derivatives
(2R)-2-ammonio-3-phenylpropanoate	6919011	Click to see C1=CC=C(C=C1)CC(C(=O)[O-])[NH3+]	165.19	unknown	via CMAUP database
D-phenylalanine	71567	Click to see C1=CC=C(C=C1)CC(C(=O)O)N	165.19	unknown	https://doi.org/10.1007/978-3-642-48618-0_9
L-Phenylalanine, 23	57397115	Click to see C1=CC=C(C=C1)CC(C(=O)[O-])[NH3+]	165.19	unknown	via CMAUP database
Phenylalanine	6140	Click to see C1=CC=C(C=C1)CC(C(=O)O)N	165.19	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Amino acids and derivatives / Beta amino acids and derivatives
(3S)-3-azaniumyl-3-phenylpropanoate	6921435	Click to see C1=CC=C(C=C1)C(CC(=O)[O-])[NH3+]	165.19	unknown	via CMAUP database
3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoate	167945	Click to see CC(C)(CO)C(C(=O)NCCC(=O)[O-])O	218.23	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides / Cyclic peptides
(2S)-N-[(2S)-1-[(3S,7R,10S,13Z)-10-benzyl-16-methoxy-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.3.1.03,7]nonadeca-1(19),13,15,17-tetraen-6-yl]-1-oxo-3-phenylpropan-2-yl]-2-(dimethylamino)-3-phenylpropanamide	163195021	Click to see CN(C)C(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)N3CCC4C3C(=O)NC(C(=O)NC=CC5=C(C=CC(=C5)O4)OC)CC6=CC=CC=C6	729.90	unknown	https://doi.org/10.1016/S0031-9422(00)88967-0
2-(dimethylamino)-N-[(10E)-7-(1-hydroxy-2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylpropanamide	14729081	Click to see CC(C)C1C(C(=O)NC(C(=O)NC=CC2=CC=C(O1)C=C2)C(C(C)C)O)NC(=O)C(CC3=CC=CC=C3)N(C)C	550.70	unknown	https://doi.org/10.1016/0031-9422(90)80207-W
Sanjoinenine	14729078	Click to see CC(C)CC1C(=O)NC=CC2=CC=C(C=C2)OC(C(C(=O)N1)NC(=O)C=CC3=CC=CC=C3)C(C)C	489.60	unknown	https://doi.org/10.1016/0031-9422(90)80207-W
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides / Oligopeptides
(13Z)-10-butan-2-yl-6-[2-(3,4-dimethyl-5-oxoimidazolidin-1-yl)-3-methylbutanoyl]-16-methoxy-2-oxa-6,9,12-triazatricyclo[13.3.1.03,7]nonadeca-1(18),13,16-triene-8,11-dione	101419713	Click to see CCC(C)C1C(=O)NC=CC2CC(=CC=C2OC)OC3CCN(C3C(=O)N1)C(=O)C(C(C)C)N4CN(C(C4=O)C)C	571.70	unknown	https://doi.org/10.1016/S0031-9422(00)80723-2
(2S,3R)-N-[(3S,4S,7S,10E)-7-benzyl-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-2-(dimethylamino)-3-methylpentanamide	102239804	Click to see CCC(C)C(C(=O)NC1C(OC2=CC=C(C=C2)C=CNC(=O)C(NC1=O)CC3=CC=CC=C3)C(C)C)N(C)C	534.70	unknown	https://doi.org/10.1016/S0367-326X(01)00278-7
(2S,3S)-N-[(2S)-1-[(3S,7S,10S,13Z)-10-[(2R)-butan-2-yl]-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.2.2.03,7]nonadeca-1(18),13,15(19),16-tetraen-6-yl]-4-methyl-1-oxopentan-2-yl]-2-(dimethylamino)-3-methylpentanamide	102146051	Click to see CCC(C)C1C(=O)NC=CC2=CC=C(C=C2)OC3CCN(C3C(=O)N1)C(=O)C(CC(C)C)NC(=O)C(C(C)CC)N(C)C	597.80	unknown	via CMAUP database
(2S)-2-(dimethylamino)-N-[(3R,4S,7S,10E)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylpropanamide	101921947	Click to see CC(C)CC1C(=O)NC=CC2=CC=C(C=C2)OC(C(C(=O)N1)NC(=O)C(CC3=CC=CC=C3)N(C)C)C(C)C	534.70	unknown	https://doi.org/10.1248/BPB.31.1749 https://doi.org/10.1016/S0031-9422(00)82518-2 https://doi.org/10.1007/BF02857740
2-(dimethylamino)-N-[11-methoxy-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),12,15-trien-4-yl]-3-phenylpropanamide	75072105	Click to see CC(C)CC1C(=O)NCC(C2=CC=C(C=C2)OC(C(C(=O)N1)NC(=O)C(CC3=CC=CC=C3)N(C)C)C(C)C)OC	566.70	unknown	https://doi.org/10.1016/0031-9422(90)80207-W
2-(methylamino)-N-[(10E)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylpropanamide	14729076	Click to see CC(C)CC1C(=O)NC=CC2=CC=C(C=C2)OC(C(C(=O)N1)NC(=O)C(CC3=CC=CC=C3)NC)C(C)C	520.70	unknown	https://doi.org/10.1016/0031-9422(90)80207-W
Amphibine D	12306074	Click to see CCC(C)C1C(=O)NC=CC2=CC=C(C=C2)OC3CCN(C3C(=O)N1)C(=O)C(C(C)CC)NC(=O)C(CC4=CC=CC=C4)N(C)C	631.80	unknown	https://doi.org/10.1016/0031-9422(90)80207-W
Benzenepropanamide, alpha-(dimethylamino)-N-[2-methyl-1-[[3,3a,11,12,13,14,15,15a-octahydro-13-(1-methylpropyl)-12,15-dioxo-5,8-ethenopyrrolo[3,2-b][1,5,8]oxadiazacyclotetradecin-1(2H)-yl]carbonyl]butyl]-	5318120	Click to see CCC(C)C1C(=O)NC=CC2=CC=C(C=C2)OC3CCN(C3C(=O)N1)C(=O)C(C(C)CC)NC(=O)C(CC4=CC=CC=C4)N(C)C	631.80	unknown	https://doi.org/10.1016/0031-9422(90)80207-W
Ceanothamine B	5316533	Click to see CCC(C)C1C(=O)NC=CC2=CC=C(C=C2)OC(C(C(=O)N1)NC(=O)C(CC(C)C)N(C)C)C(C)C	500.70	unknown	via CMAUP database
Daechuine S8-1	102155153	Click to see CC(C)CC1C(=O)NC=CC2=C(C=CC(=C2)OC3CCN(C3C(=O)N1)C(=O)C(CC(C)C)NC(=O)C(CC(C)C)N(C)C)OC	627.80	unknown	via CMAUP database
Daechuine-S3	101204326	Click to see CCC(C)C1C(=O)NC=CC2=C(C=CC(=C2)OC3CCN(C3C(=O)N1)C(=O)C(C(C)CC)NC(=O)C(C(C)CC)N(C)C)OC	627.80	unknown	via CMAUP database
Frangufoline	5317387	Click to see CC(C)CC1C(=O)NC=CC2=CC=C(C=C2)OC(C(C(=O)N1)NC(=O)C(CC3=CC=CC=C3)N(C)C)C(C)C	534.70	unknown	https://doi.org/10.1016/S0031-9422(00)82518-2 https://doi.org/10.1007/BF02857740 https://doi.org/10.1248/BPB.31.1749
Jubanine A	101316794	Click to see CCC(C)C1C(=O)NC=CC2=C(C=CC(=C2)OC3CCN(C3C(=O)N1)C(=O)C(CC4=CC=CC=C4)NC(=O)C(CC5=CC=CC=C5)N(C)C)OC	695.80	unknown	via CMAUP database
Jubanine B	101316795	Click to see CN(C)C(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)N3CCC4C3C(=O)NC(C(=O)NC=CC5=C(C=CC(=C5)O4)OC)CC6=CC=CC=C6	729.90	unknown	via CMAUP database
Jubanine C	131752168	Click to see CCC(C)C(C(=O)N1CCCC1C(=O)NC2C(OC3=CC=C(C=C3)C=CNC(=O)C(NC2=O)CC4=CC=CC=C4)C5=CC=CC=C5)N(C)C	665.80	unknown	https://doi.org/10.1016/S0367-326X(01)00278-7
Mauritine A	11353668	Click to see CC(C)C(C(=O)N1CCC2C1C(=O)NC(C(=O)NC=CC3=CC=C(O2)C=C3)CC4=CC=CC=C4)NC(=O)C(C)N(C)C	575.70	unknown	via CMAUP database
N-[1-(10-benzyl-16-methoxy-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.3.1.03,7]nonadeca-1(19),13,15,17-tetraen-6-yl)-1-oxo-3-phenylpropan-2-yl]-2-(dimethylamino)-3-phenylpropanamide	163008569	Click to see CN(C)C(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)N3CCC4C3C(=O)NC(C(=O)NC=CC5=C(C=CC(=C5)O4)OC)CC6=CC=CC=C6	729.90	unknown	https://doi.org/10.1016/S0031-9422(00)88967-0
N-[1-(10-butan-2-yl-16-methoxy-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.3.1.03,7]nonadeca-1(19),13,15,17-tetraen-6-yl)-1-oxo-3-phenylpropan-2-yl]-2-(dimethylamino)-3-phenylpropanamide	163073449	Click to see CCC(C)C1C(=O)NC=CC2=C(C=CC(=C2)OC3CCN(C3C(=O)N1)C(=O)C(CC4=CC=CC=C4)NC(=O)C(CC5=CC=CC=C5)N(C)C)OC	695.80	unknown	https://doi.org/10.1016/S0031-9422(00)88967-0
N-[1-[(13Z)-10-benzyl-16-methoxy-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.3.1.03,7]nonadeca-1(19),13,15,17-tetraen-6-yl]-3-methyl-1-oxobutan-2-yl]-2-formamido-3-methylbutanamide	102156891	Click to see CC(C)C(C(=O)NC(C(C)C)C(=O)N1CCC2C1C(=O)NC(C(=O)NC=CC3=C(C=CC(=C3)O2)OC)CC4=CC=CC=C4)NC=O	633.70	unknown	https://doi.org/10.1016/S0031-9422(00)80724-4
Pentanamide, 2-(dimethylamino)-3-methyl-N-[3-(1-methylethyl)-7-(2-methylpropyl)-5,8-dioxo-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-, [3R-[3R,4S(2S,3S),7S*]]-	5370447	Click to see CCC(C)C(C(=O)NC1C(OC2=CC=C(C=C2)C=CNC(=O)C(NC1=O)CC(C)C)C(C)C)N(C)C	500.70	unknown	via CMAUP database
scutianine C	45268911	Click to see CCC(C)C(C(=O)NC1C(OC2=CC=C(C=C2)C=CNC(=O)C(NC1=O)CC3=CC=CC=C3)C(C)C)N(C)C	534.70	unknown	via CMAUP database
Zizyphine A	6324833	Click to see CCC(C)C(C(=O)N1CCC2C1C(=O)N3CCCC3C(=O)NC=CC4=C(C=C(O2)C=C4)OC)NC(=O)C(C(C)CC)N(C)C	611.80	unknown	https://doi.org/10.1016/S0367-326X(01)00278-7
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters
(-)-9-Acetoxygymnomitr-8(12)-ene	636493	Click to see CC(=O)OC1CC2(CC(C1=C)C3(C2(CCC3)C)C)C	262.40	unknown	https://doi.org/10.1021/NP50040A006
> 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 / Dicarboxylic acids and derivatives
Butanedioate;hydron	21952380	Click to see [H+].[H+].C(CC(=O)[O-])C(=O)[O-]	118.09	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
2-(Carboxymethyl)-2-hydroxybutanedioate;hydron	88113319	Click to see [H+].[H+].C(C(=O)O)C(CC(=O)[O-])(C(=O)[O-])O	192.12	unknown	via CMAUP database
> Organic acids and derivatives / Hydroxy acids and derivatives / Beta hydroxy acids and derivatives
(2S)-2-Hydroxybutanedioic acid	222656	Click to see C(C(C(=O)O)O)C(=O)O	134.09	unknown	via CMAUP database
D-malate	92824	Click to see C(C(C(=O)O)O)C(=O)O	134.09	unknown	via CMAUP database
Hydron;2-hydroxybutanedioate	20130941	Click to see [H+].[H+].C(C(C(=O)[O-])O)C(=O)[O-]	134.09	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
(-)-Quinate	1560034	Click to see C1C(C(C(CC1(C(=O)[O-])O)O)O)O	191.16	unknown	via CMAUP database
(+)-Quinic acid	37439	Click to see C1C(C(C(CC1(C(=O)O)O)O)O)O	192.17	unknown	via CMAUP database
Chlorogenic Acid	1794427	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	via CMAUP database
Chlorogensaure	12310830	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	via CMAUP database
cis-Chlorogenic acid	1794425	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	via CMAUP database
Quinic acid	6508	Click to see C1C(C(C(CC1(C(=O)O)O)O)O)O	192.17	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / C-glycosyl compounds
Ethyl alpha-D-fructofuranoside	133590	Click to see CCOC1(C(C(C(O1)CO)O)O)CO	208.21	unknown	https://doi.org/10.1248/YAKUSHI1947.101.8_700
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
alpha-D-Glucopyranoside, beta-D-fructofuranosyl	91692850	Click to see C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O	342.30	unknown	via CMAUP database
Sucrose	5988	Click to see C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O	342.30	unknown	https://doi.org/10.1007/978-3-642-48618-0_9
Sucrose NF	46782954	Click to see C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O	342.30	unknown	via CMAUP database
Zizybeoside I	11972301	Click to see C1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)O)OC3C(C(C(C(O3)CO)O)O)O	432.40	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides
D-Fructose	2723872	Click to see C1C(C(C(C(O1)(CO)O)O)O)O	180.16	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Hexoses
D-Glucose	5793	Click to see C(C1C(C(C(C(O1)O)O)O)O)O	180.16	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Oligosaccharides
Glc(b1-2)[Glc(b1-3)]Glc(b)-O-Bn	11968322	Click to see C1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)OC3C(C(C(C(O3)CO)O)O)O)OC4C(C(C(C(O4)CO)O)O)O	594.60	unknown	via CMAUP database
Zizybeoside II	46173942	Click to see C1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)OC3C(C(C(C(O3)CO)O)O)O)OC4C(C(C(C(O4)CO)O)O)O	594.60	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives
2,3-Dihydroxybutanedioate;hydron	21583978	Click to see [H+].[H+].C(C(C(=O)[O-])O)(C(=O)[O-])O	150.09	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
2,4,5,6-tetrahydro-1H-cyclopenta[d][1,3]oxazin-7-one	5316289	Click to see C1CC(=O)C2=C1COCN2	139.15	unknown	https://doi.org/10.1007/BF02857741
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones
8-Benzoyl-3-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-9,9-dimethyl-6,10-bis(3-methylbut-2-enyl)-4-oxatricyclo[6.3.1.01,5]dodec-5-ene-7,12-dione	75104405	Click to see CC(=CCC1CC23CC(OC2=C(C(=O)C(C3=O)(C1(C)C)C(=O)C4=CC=CC=C4)CC=C(C)C)C5(CCC(O5)C(C)(C)O)C)C	602.80	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
> Organic oxygen compounds / Organooxygen compounds / Ethers / Acetals / Ketals
Ethyl beta-fructopyranoside	6325163	Click to see CCOC1(C(C(C(CO1)O)O)O)CO	208.21	unknown	https://doi.org/10.1248/YAKUSHI1947.101.8_700
> Organoheterocyclic compounds / Benzodioxoles
Myristicin	4276	Click to see COC1=CC(=CC2=C1OCO2)CC=C	192.21	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 / Dihydrofurans / Furanones / Butenolides
Ascorbic Acid	54670067	Click to see C(C(C1C(=C(C(=O)O1)O)O)O)O	176.12	unknown	via CMAUP database
D-ascorbic acid	54690394	Click to see C(C(C1C(=C(C(=O)O1)O)O)O)O	176.12	unknown	via CMAUP database
L-[2-13C]ascorbic acid	54676536	Click to see C(C(C1C(=C(C(=O)O1)O)O)O)O	176.12	unknown	via CMAUP database
> Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives
2-amino-3,7-dihydropurin-6-one	764	Click to see C1=NC2=C(N1)C(=O)N=C(N2)N	151.13	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 / Imidazopyrimidines / Purines and purine derivatives / Purinones / Hypoxanthines
CID 790	790	Click to see C1=NC2=C(N1)C(=O)N=CN2	136.11	unknown	via CMAUP database
> Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / Xanthines
Xanthine	1188	Click to see C1=NC2=C(N1)C(=O)NC(=O)N2	152.11	unknown	via CMAUP database
> Organoheterocyclic compounds / Indoles and derivatives / Carbazoles / Pyrrolocarbazoles / Indolocarbazoles
3-Hydroxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one	5230524	Click to see CC12C(C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)NC)O	452.50	unknown	https://doi.org/10.1055/S-2007-969269 https://doi.org/10.1055/S-2007-969308
> Organoheterocyclic compounds / Indoles and derivatives / Indoles / 3-alkylindoles
Melatonin	896	Click to see CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC	232.28	unknown	https://doi.org/10.1016/S0024-3205(03)00252-2
> Organoheterocyclic compounds / Isoquinolines and derivatives / Benzylisoquinolines
Coclaurine	160487	Click to see COC1=C(C=C2C(NCCC2=C1)CC3=CC=C(C=C3)O)O	285.34	unknown	https://doi.org/10.1007/BF02857740 https://doi.org/10.1007/BF02911058
Machiline	281691	Click to see COC1=C(C=C2C(NCCC2=C1)CC3=CC=C(C=C3)O)O	285.34	unknown	https://doi.org/10.1007/BF02857740 https://doi.org/10.1007/BF02911058
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
2(3H)-Furanone, dihydro-5,5-dimethyl-4-(3-oxobutyl)-	138243	Click to see CC(=O)CCC1CC(=O)OC1(C)C	184.23	unknown	via CMAUP database
> Organoheterocyclic compounds / Oxanes
Eucalyptol	2758	Click to see CC1(C2CCC(O1)(CC2)C)C	154.25	unknown	via CMAUP database
> Organoheterocyclic compounds / Pteridines and derivatives / Alloxazines and isoalloxazines / Flavins
Riboflavin	493570	Click to see CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(CO)O)O)O	376.40	unknown	via CMAUP database
> Organoheterocyclic compounds / Pyridines and derivatives / Pyridinecarboxylic acids and derivatives / Pyridinecarboxylic acids
Nicotinic acid	938	Click to see C1=CC(=CN=C1)C(=O)O	123.11	unknown	via CMAUP database
> Organoheterocyclic compounds / Pyrrolidines
Maltoxazine	13875298	Click to see C1CC2N(C1)C3=C(CCC3=O)CO2	179.22	unknown	https://doi.org/10.1007/BF02857741
> Phenylpropanoids and polyketides / Cinnamaldehydes
Cinnamaldehyde	637511	Click to see C1=CC=C(C=C1)C=CC=O	132.16	unknown	via CMAUP database
cis-Cinnamaldehyde	6428995	Click to see C1=CC=C(C=C1)C=CC=O	132.16	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Cinnamic acids
Cinnamic acid	444539	Click to see C1=CC=C(C=C1)C=CC(=O)O	148.16	unknown	via CMAUP database
cis-Cinnamic acid	5372954	Click to see C1=CC=C(C=C1)C=CC(=O)O	148.16	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
[(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-(4-hydroxyphenyl)-7-methoxy-4-oxo-5,6-dihydrochromen-6-yl]oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate	5321319	Click to see COC1=CC2=C(CC1C3C(C(C(C(O3)CO)O)O)OC4C(C(C(C(O4)COC(=O)C=CC5=CC(=C(C(=C5)OC)O)OC)O)O)O)C(=O)C=C(O2)C6=CC=C(C=C6)O	800.80	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
Caffeic Acid	689043	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	via CMAUP database
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	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins
Scopoletin	5280460	Click to see COC1=C(C=C2C(=C1)C=CC(=O)O2)O	192.17	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Anthocyanidins
Flavylium	145858	Click to see C1=CC=C(C=C1)C2=[O+]C3=CC=CC=C3C=C2	207.25	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
(-)-Epiafzelechin-(4beta-8)-(-)-epicatechin	10239837	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)O	562.50	unknown	https://doi.org/10.1007/BF02291535
(-)-Epicatechin-(4beta->8)-(-)-epigallocatechin	14284603	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C(=C6)O)O)O)O	594.50	unknown	https://doi.org/10.1007/BF02291535
(2R,2'R,3R,3'R)-2,2'-Bis(3,4-dihydroxyphenyl)-3,3',4,4'-tetrahydro-2H,2'H-4,8'-bichromene-3,3',5,5',7,7'-hexol	5320711	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O	578.50	unknown	via CMAUP database
(2R,3R,4R)-4-[(2R,3R,4R)-4-[(2R,3R,4S)-4-[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol	162969754	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC(=C4C5C(C(OC6=C(C(=CC(=C56)O)O)C7C(C(OC8=C(C(=CC(=C78)O)O)C9C(C(OC1=CC(=CC(=C91)O)O)C1=CC=C(C=C1)O)O)C1=CC(=C(C(=C1)O)O)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O	1475.30	unknown	https://doi.org/10.1007/BF02291535
(2R,3R,4R)-4-[(2R,3S,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R,4S)-4-[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol	163192134	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC(=C4C5C(C(OC6=C5C(=CC(=C6C7C(C(OC8=C(C(=CC(=C78)O)O)C9C(C(OC1=CC(=CC(=C91)O)O)C1=CC=C(C=C1)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O	1459.30	unknown	https://doi.org/10.1007/BF02291535
(2R,3R,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol	15403180	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC=C(C=C7)O)O)C8=CC(=C(C=C8)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O	850.80	unknown	https://doi.org/10.1007/BF02291535
(2R,3R,4S)-4-[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol	15403179	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC=C(C=C7)O)O)C8=CC(=C(C(=C8)O)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O	866.80	unknown	https://doi.org/10.1007/BF02291535
(2R,3R)-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol	15403178	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC=C(C=C5)O)O)O)O)C6=CC(=C(C(=C6)O)O)O)O	578.50	unknown	https://doi.org/10.1007/BF02291535
2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol	73193906	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC=C(C=C7)O)O)C8=CC(=C(C=C8)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O	850.80	unknown	https://doi.org/10.1007/BF02291535
2-(3,4-dihydroxyphenyl)-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol	5089688	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)O	562.50	unknown	https://doi.org/10.1007/BF02291535
4-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol	73193905	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC=C(C=C7)O)O)C8=CC(=C(C(=C8)O)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O	866.80	unknown	https://doi.org/10.1007/BF02291535
4-[2-(3,4-dihydroxyphenyl)-4-[4-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol	162898516	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC(=C4C5C(C(OC6=C5C(=CC(=C6C7C(C(OC8=C(C(=CC(=C78)O)O)C9C(C(OC1=CC(=CC(=C91)O)O)C1=CC=C(C=C1)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O	1459.30	unknown	https://doi.org/10.1007/BF02291535
4-[4-[4-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol	162969753	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC(=C4C5C(C(OC6=C(C(=CC(=C56)O)O)C7C(C(OC8=C(C(=CC(=C78)O)O)C9C(C(OC1=CC(=CC(=C91)O)O)C1=CC=C(C=C1)O)O)C1=CC(=C(C(=C1)O)O)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O	1475.30	unknown	https://doi.org/10.1007/BF02291535
8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol	73193904	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC=C(C=C5)O)O)O)O)C6=CC(=C(C(=C6)O)O)O)O	578.50	unknown	https://doi.org/10.1007/BF02291535
Endotelon	130556	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O	578.50	unknown	https://doi.org/10.1007/BF02291535
Epicatechin-(4beta->8)-gallocatechin	14284599	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C(=C6)O)O)O)O	594.50	unknown	https://doi.org/10.1007/BF02291535
Procyanidin B2, (+)-	122738	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O	578.50	unknown	https://doi.org/10.1007/BF02291535
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
(-)-Catechin	73160	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O	290.27	unknown	via CMAUP database
(+)-Epicatechin	182232	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O	290.27	unknown	via CMAUP database
2-(3,4-Dihydroxyphenyl)chroman-3,5,7-triol	1203	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O	290.27	unknown	https://doi.org/10.1007/BF02291535
Cianidanol	9064	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O	290.27	unknown	https://doi.org/10.1007/BF02291535
Epicatechin	72276	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O	290.27	unknown	https://doi.org/10.1016/J.BSE.2013.04.001 https://doi.org/10.1007/BF02291535
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Catechin gallates
(-)-Epicatechin gallate	107905	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	442.40	unknown	https://doi.org/10.1007/BF02291535
(-)-Epicatechingallate	367141	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	442.40	unknown	https://doi.org/10.1007/BF02291535
(+)-Catechin gallate	5276454	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	442.40	unknown	https://doi.org/10.1007/BF02291535
5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl 3,4,5-trihydroxybenzoate	1287	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	458.40	unknown	https://doi.org/10.1007/BF02291535
Epigallocatechin Gallate	65064	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	458.40	unknown	https://doi.org/10.1007/BF02291535
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Epigallocatechins
(-)-Gallocatechin	9882981	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O	306.27	unknown	https://doi.org/10.1016/J.BSE.2013.04.001
Epigallocatechin	72277	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O	306.27	unknown	https://doi.org/10.1007/BF02291535
Flavan-3,3',4',5,5',7-hexol	1249	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O	306.27	unknown	https://doi.org/10.1007/BF02291535
Gallocatechin	65084	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O	306.27	unknown	https://doi.org/10.1007/BF02291535
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavan-3-ols
(-)-Epiafzelechin	443639	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC=C(C=C3)O)O	274.27	unknown	https://doi.org/10.1007/BF02291535
2-(4-Hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol	282014	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC=C(C=C3)O)O	274.27	unknown	https://doi.org/10.1007/BF02291535
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones / Flavanonols
3,5,7-Trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one	662	Click to see C1=CC(=CC=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O	288.25	unknown	https://doi.org/10.1016/J.BSE.2013.04.001
Aromadendrin	122850	Click to see C1=CC(=CC=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O	288.25	unknown	https://doi.org/10.1016/J.BSE.2013.04.001
> Phenylpropanoids and polyketides / Flavonoids / Flavones
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
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
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/10.1055/S-2007-969308
Myricetin	5281672	Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O	318.23	unknown	https://doi.org/10.1055/S-2007-969308
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/10.1016/J.BSE.2013.04.001
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides
[(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxochromen-6-yl]-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate	11972349	Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OC3C(C(C(OC3C4=C(C=C5C(=C4O)C(=O)C=C(O5)C6=CC=C(C=C6)O)OC)CO)O)O)O)O)O)O	784.70	unknown	via CMAUP database
[(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-7-methyl-4-oxochromen-6-yl]-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate	5316122	Click to see CC1=CC2=C(C(=O)C=C(O2)C3=CC=C(C=C3)O)C(=C1C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)COC(=O)C=CC6=CC(=C(C=C6)O)OC)O)O)O)O	768.70	unknown	via CMAUP database
[6-[4,5-Dihydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxochromen-6-yl]-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate	73157747	Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OC3C(C(C(OC3C4=C(C=C5C(=C4O)C(=O)C=C(O5)C6=CC=C(C=C6)O)OC)CO)O)O)O)O)O)O	784.70	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5 https://doi.org/10.1007/S10600-011-9936-Y
5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one	4475102	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)C4C(C(C(C(O4)CO)O)O)O)O)O	432.40	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
6-[(2S,3R,4S,5S,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one	160702278	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O	594.50	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
6-[4,5-Dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one	14730433	Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O)C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O	608.50	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5 https://doi.org/10.1007/S10600-011-9936-Y
6-beta-D-Glucopyranosyl-4',5-dihydroxy-7-methoxyflavone	369636	Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O)C4C(C(C(C(O4)CO)O)O)O	446.40	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
6'''-Feruloylspinosin	21597353	Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OC3C(C(C(OC3C4=C(C=C5C(=C4O)C(=O)C=C(O5)C6=CC=C(C=C6)O)OC)CO)O)O)O)O)O)O	784.70	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5 https://doi.org/10.1007/S10600-011-9936-Y
6'''-p-Hydroxybenzoylspinosin	101616452	Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O)C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)COC(=O)C6=CC=C(C=C6)O)O)O)O	728.60	unknown	via CMAUP database
6'''-Sinapoylspinosin	101616450	Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)OCC2C(C(C(C(O2)OC3C(C(C(OC3C4=C(C=C5C(=C4O)C(=O)C=C(O5)C6=CC=C(C=C6)O)OC)CO)O)O)O)O)O	814.70	unknown	via CMAUP database
7-O-Methylapigenin 6-C-beta-D-glucopyranoside	44258316	Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O)C4C(C(C(C(O4)CO)O)O)O	446.40	unknown	via CMAUP database
Glucoisovitexin	323971	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O	594.50	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
Isovitexin	162350	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)C4C(C(C(C(O4)CO)O)O)O)O)O	432.40	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
Meloside A	185995	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O	594.50	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
Spinosin	155692	Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O)C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O	608.50	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5 https://doi.org/10.1248/CPB.45.1186 https://doi.org/10.1007/S10600-011-9936-Y https://doi.org/10.1007/BF02856299
Swertisin	124034	Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O)C4C(C(C(C(O4)CO)O)O)O	446.40	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides
[(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5S,6S)-4,5-dihydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxochromen-8-yl]-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate	163105240	Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OC3C(C(C(OC3C4=C(C=C(C5=C4OC(=CC5=O)C6=CC=C(C=C6)O)O)OC)CO)O)O)O)O)O)O	784.70	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
5,7-dihydroxy-2-(4-hydroxyphenyl)-6,8-bis[(2S,4R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one	44257674	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C(=C3O2)C4C(C(C(C(O4)CO)O)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O	594.50	unknown	https://doi.org/10.1248/CPB.45.1186
Isospinosin	11801844	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=CC=C(C=C3)O)C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O	608.50	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
Vicenin 2	442664	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C(=C3O2)C4C(C(C(C(O4)CO)O)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O	594.50	unknown	via CMAUP database
Vitexin	5280441	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O	432.40	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
(2S,3R,4S,5S,6R)-2-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-chroman-5-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol	10343835	Click to see C1C(C(OC2=C1C(=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C=C4)O)O)O	452.40	unknown	via CMAUP database
Flavocommelitin 4'-beta-D-glucopyranoside	44258346	Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)O)C5C(C(C(C(O5)CO)O)O)O	608.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
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-4-oxo-4H-chromen-3-yl D-galactopyranoside	11751616	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
Hyperasid	90657624	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-]	463.40	unknown	via CMAUP database
Hyperoside	5281643	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/10.1021/JF302848U
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	via CMAUP database
Quercetin 3-robinobioside	44259100	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	via CMAUP database
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/10.1016/J.BSE.2013.04.001
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/10.1021/JF302848U
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
Isocytisoside 7-O-glucoside	44257882	Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O	608.50	unknown	via CMAUP database
Kaempferol 7-neohesperidoside	5483905	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=C3)OC(=C(C4=O)O)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	594.50	unknown	via CMAUP database
Saponarin	441381	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O	594.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Hydroxyflavonoids / 7-hydroxyflavonoids
(2S,3S)-2-(3,4-dihydroxyphenyl)-3-methyl-3,4-dihydro-2H-chromene-5,7-diol	44445800	Click to see CC1CC2=C(C=C(C=C2OC1C3=CC(=C(C=C3)O)O)O)O	288.29	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 3-O-methylated flavonoids
Chryseriol	5280666	Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O	300.26	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Isoflavonoids / Coumestans
Coumestrol	5281707	Click to see C1=CC2=C(C=C1O)OC3=C2C(=O)OC4=C3C=CC(=C4)O	268.22	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Isoflavonoids / Isoflavonoid C-glycosides
[6-[4,5-Dihydroxy-2-[5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4-oxochromen-8-yl]-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate	162987097	Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OC3C(C(C(OC3C4=C(C=C(C5=C4OC=C(C5=O)C6=CC=C(C=C6)O)O)OC)CO)O)O)O)O)O)O	784.70	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
7-hydroxy-3-(4-hydroxyphenyl)-8-[(2S,3S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one	53384442	Click to see C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3C4C(C(C(C(O4)CO)O)O)O)O)O	416.40	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
7-Hydroxy-3-(4-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one	5385074	Click to see C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3C4C(C(C(C(O4)CO)O)O)O)O)O	416.40	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
8-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5-hydroxy-3-(4-hydroxyphenyl)-7-methoxychromen-4-one	163016249	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C(=CO2)C3=CC=C(C=C3)O)C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O	608.50	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
8-[4,5-Dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5-hydroxy-3-(4-hydroxyphenyl)-7-methoxychromen-4-one	163016248	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C(=CO2)C3=CC=C(C=C3)O)C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O	608.50	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
Puerarin	5281807	Click to see C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3C4C(C(C(C(O4)CO)O)O)O)O)O	416.40	unknown	https://doi.org/10.1016/S0040-4020(00)00842-5
> Phenylpropanoids and polyketides / Phenylpropanoic acids
3-Phenylpropionate	4740700	Click to see C1=CC=C(C=C1)CCC(=O)[O-]	149.17	unknown	via CMAUP database
3-Phenylpropionic acid	107	Click to see C1=CC=C(C=C1)CCC(=O)O	150.17	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins
Ellagic Acid	5281855	Click to see C1=C2C3=C(C(=C1O)O)OC(=O)C4=CC(=C(C(=C43)OC2=O)O)O	302.19	unknown	via CMAUP database
Pseudolaroside B	98774697	Click to see COC1=C(C=CC(=C1)C(=O)O)OC2C(C(C(C(O2)CO)O)O)O	330.29	unknown	via CMAUP database

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Ziziphus jujuba

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