Scientific name	Authority	First published in
Justicia paniculata	Burm.f.	Fl. Indica : 9 (1768)
Justicia latebrosa	Russ. ex Wall.	Numer. List : n.º 2454 (1830)
Andrographis paniculata var. glandulosa	Trimen	J. Bot. 27: 165 1889

Common names Top

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Filter by language:

Language	Common/alternative name
Arabic	أندروغرافيس بانيكولاتا
Azerbaijani	süpürgəvari androqrafis
ban	samiroto
Bengali	আলুই
Bengali	কালমেঘ
Czech	právenka latnatá
German	kalmegh
Finnish	rohtokirata
Gujarati	કરિયાતું
Hindi	कालमेघ
Indonesian	sambiloto
Japanese	センシンレン
jv	sambiloto
Kannada	ನೆಲಬೇವು
mad	kaḍḍâs
mad	ambherta
min	ampadu tanah
Malayalam	കിരിയാറ്റ്
Malayalam	നിലവേപ്പ്
mnw	မြေက်ဗြီု
Burmese	ဆေးခါးကြီး(ငရုတ်ခါး)
Nepali	कल्पनाथ
Oriya	ଭୂଇଁନିମ
Polish	brodziuszka wiechowata
Portuguese	haplanthoides
Portuguese	haplanthus
Russian	穿心莲 (chuan xin lian, кит.)
Russian	bhunimba (англ.)
Russian	Андрографис метельчатый
Russian	creat (англ.)
Russian	кальмег
Russian	roi des amers (фр.)
Russian	kirata (англ.)
Russian	king of bitter (англ.)
Russian	kalmegh (англ.)
Russian	green chiretta (англ.)
sa	अश्वत्थः
sa	कालमेघः
sd	ڪريات
Sinhala	හීං බිංකොහොඹ
su	sambiloto
szy	nipaluma-sakiatay
Tamil	நிலவேம்பு
Telugu	నేలవేము
Thai	ฟ้าทะลายโจร
Vietnamese	khô đảm thảo
Vietnamese	xuyên tâm liên
Vietnamese	lam khái liên
Vietnamese	công cộng
Vietnamese	cây lá đắng
za	nyafaenzlenz
Chinese	榄核莲
Chinese	印度草
Chinese	一见喜
Chinese	穿心蓮
Chinese	穿心莲

Subspecies (abbr. subsp./ssp.) Top

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No subspecies added yet.

Varieties (abbr. var.) Top

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No variety added yet.

Subvarieties (abbr. subvar.) Top

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Forms (abbr. f.) Top

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No forms added yet.

Germination/Propagation Top

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No germination or propagation data was added yet.

Distribution (via POWO/KEW) Top

Legend for the distribution data:

- Doubtful data

- Extinct

- Introduced

- Native

Asia-temperate click to expand
- China
  - China South-central
  - China Southeast
  - Hainan

Asia-tropical click to expand
- Indian Subcontinent
  - Assam
  - Bangladesh
  - India
  - Nepal
  - Sri Lanka
  - West Himalaya
- Indo-China
  - Andaman Islands
  - Cambodia
  - Laos
  - Myanmar
  - Thailand
  - Vietnam
- Malesia
  - Borneo
  - Christmas Island
  - Lesser Sunda Islands
  - Malaya

Northern America click to expand
- Mexico
  - Mexico Central
  - Mexico Gulf

Pacific click to expand
- Northwestern Pacific
  - Caroline Islands
- South-central Pacific
  - Society Islands

Southern America click to expand
- Caribbean
  - Bahamas
  - Cuba
  - Dominican Republic
  - Haiti
  - Leeward Islands
  - Windward Islands

Links to other databases Top

Suggest others/fix!

Database	ID/link to page
World Flora Online	wfo-0000534069
UNII	0P49L952WZ
Tropicos	100007
INPN	448561
KEW	urn:lsid:ipni.org:names:45226-1
The Plant List	kew-2637069
Open Tree Of Life	275698
NCBI Taxonomy	175694
IPNI	45226-1
iNaturalist	143423
GBIF	3173178
Freebase	/m/026wsbj
EPPO	ADGPA
EOL	595191
USDA GRIN	414228
Wikipedia	Andrographis_paniculata
CMAUP	NPO12061
CMAUP	NPO3578
PFAF	Andrographis paniculata

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_009805555.1	ASM980555v1	Contig	Guangxi Botanical Garden of Medicinal Plants	2019-12-27	10.0x	271.14 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

On-farm crop diversity, conservation, importance and value: a case study of landraces from Western Ghats of Karnataka, India

Puneeth GM, Gowthami R, Katral A, Laxmisha KM, Vasudeva R, Singh GP, Archak S

Sci Rep

10-May-2024

PMCID:	PMC11087530
doi:	10.1038/s41598-024-61428-1
PMID:	38730080

Potential Effects of Traditional Chinese Medicine in Anti-Aging and Aging-Related Diseases: Current Evidence and Perspectives

Ding X, Ma X, Meng P, Yue J, Li L, Xu L

Clin Interv Aging

01-May-2024

PMCID:	PMC11070163
doi:	10.2147/CIA.S447514
PMID:	38706635

Systematic Review of Chemical Compounds with Immunomodulatory Action Isolated from African Medicinal Plants

Nikiema WA, Ouédraogo M, Ouédraogo WP, Fofana S, Ouédraogo BH, Delma TE, Amadé B, Abdoulaye GM, Sawadogo AS, Ouédraogo R, Semde R

Molecules

26-Apr-2024

PMCID:	PMC11085867
doi:	10.3390/molecules29092010
PMID:	38731500

Potential Targets of Natural Products for Improving Cardiac Ischemic Injury: The Role of Nrf2 Signaling Transduction

Wang H, Han J, Dmitrii G, Zhang XA

Molecules

26-Apr-2024

PMCID:	PMC11085255
doi:	10.3390/molecules29092005
PMID:	38731496

Current treatment options for leptospirosis: a mini-review

Petakh P, Behzadi P, Oksenych V, Kamyshnyi O

Front Microbiol

25-Apr-2024

PMCID:	PMC11081000
doi:	10.3389/fmicb.2024.1403765
PMID:	38725681

Tspan protein family: focusing on the occurrence, progression, and treatment of cancer

Zhang H, Song Q, Shang K, Li Y, Jiang L, Yang L

Cell Death Discov

22-Apr-2024

PMCID:	PMC11035590
doi:	10.1038/s41420-024-01961-0
PMID:	38649381

Abatement effects of different soil amendments on continuous cropping of Codonopsis pilosula

Yang Z, Qiu D, Jiang K, Du M, Li H

Front Plant Sci

19-Apr-2024

PMCID:	PMC11069315
doi:	10.3389/fpls.2024.1376362
PMID:	38708396

Dehydroandrographolide facilitates M2 macrophage polarization by downregulating DUSP3 to inhibit sepsis‐associated acute kidney injury

Shao Y, Yu W, Cai H

Immun Inflamm Dis

17-Apr-2024

PMCID:	PMC11022615
doi:	10.1002/iid3.1249
PMID:	38629726

Statistical modeling, optimization and characterization of andrographolide loaded emulgel for its therapeutic application on skin cancer through enhancing its skin permeability

V. L. Sirisha Mulukuri N, Kumar S, Dhara M, Dheeraj Rajesh G, Kumar P

Saudi Pharm J

12-Apr-2024

PMCID:	PMC11063646
doi:	10.1016/j.jsps.2024.102068
PMID:	38699597

A sustainable approach to prepare green synthesis of copper nanoparticles of Bauhinia variegata & Saussurea lappa: Unveiling in-vitro anti-obesity applications

Kumar M, Kaushik D, Kumar A, Krishnan H, Oz F, Proestos C, Hashem A, Abd_Allah EF

Heliyon

12-Apr-2024

PMCID:	PMC11031763
doi:	10.1016/j.heliyon.2024.e29433
PMID:	38644870

Study of andrographolide bioactivity against Pseudomonas aeruginosa based on computational methodology and biochemical analysis

He L, Song L, Li X, Lin S, Ye G, Liu H, Zhao X

Front Chem

12-Apr-2024

PMCID:	PMC11045890
doi:	10.3389/fchem.2024.1388545
PMID:	38680458

Traditional Chinese Medicine in Regulating Tumor Microenvironment

Wang Z, Li M, Bi L, Hu X, Wang Y

Onco Targets Ther

10-Apr-2024

PMCID:	PMC11016250
doi:	10.2147/OTT.S444214
PMID:	38617090

Nitrogen Sources Reprogram Carbon and Nitrogen Metabolism to Promote Andrographolide Biosynthesis in Andrographis paniculata (Burm.f.) Nees Seedlings

Jian S, Wan S, Lin Y, Zhong C

Int J Mol Sci

03-Apr-2024

PMCID:	PMC11012798
doi:	10.3390/ijms25073990
PMID:	38612797

Chemical Constituents and Biological Activities of Bruguiera Genus and Its Endophytes: A Review

Luo X, Chen X, Zhang L, Liu B, Xie L, Ma Y, Zhang M, Jin X

Mar Drugs

29-Mar-2024

PMCID:	PMC11050931
doi:	10.3390/md22040158
PMID:	38667775

Isolation, Characterization, and Expression Analysis of NAC Transcription Factor from Andrographis paniculata (Burm. f.) Nees and Their Role in Andrographolide Production

Kumar R, Kumar C, Roy Choudhury D, Ranjan A, Raipuria RK, Dubey KK, Mishra A, Kumar C, Manzoor MM, Kumar A, Kumari A, Singh K, Singh GP, Singh R

Genes (Basel)

28-Mar-2024

PMCID:	PMC11049156
doi:	10.3390/genes15040422
PMID:	38674357

Phytochemical Profile Top

Add a new one!

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
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives
3,4-Dihydroxybenzoate	54675866	Click to see C1=CC(=C(C=C1C(=O)O)O)[O-]	153.11	unknown	via CMAUP database
4-Hydroxybenzoic acid	135	Click to see C1=CC(=CC=C1C(=O)O)O	138.12	unknown	https://doi.org/10.1021/JF0258712
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives
Bergenin	66065	Click to see COC1=C(C=C2C(=C1O)C3C(C(C(C(O3)CO)O)O)OC2=O)O	328.27	unknown	via CMAUP database
Norbergenin	90476206	Click to see C1=C2C(=C(C(=C1O)O)O)C3C(C(C(C(O3)CO)O)O)OC2=O	314.24	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 / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Galloyl esters
[(2R,3S,4S,5R,6S)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate	11968480	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)O)O)O)O	332.26	unknown	via CMAUP database
[(2S)-2,3-dihydroxypropyl] 3,4,5-trihydroxybenzoate	51543740	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC(CO)O	244.20	unknown	via CMAUP database
11-O-Galloylbergenin	56680102	Click to see COC1=C(C=C2C(=C1O)C3C(C(C(C(O3)COC(=O)C4=CC(=C(C(=C4)O)O)O)O)O)OC2=O)O	480.40	unknown	via CMAUP database
5-Galloylshikimic acid	460897	Click to see C1C(C(C(C=C1C(=O)O)O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O	326.25	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / p-Hydroxybenzoic acid esters / p-Hydroxybenzoic acid alkyl esters
Ethylparaben	8434	Click to see CCOC(=O)C1=CC=C(C=C1)O	166.17	unknown	https://doi.org/10.1021/JF0258712
Methylparaben	7456	Click to see COC(=O)C1=CC=C(C=C1)O	152.15	unknown	https://doi.org/10.1021/JF0258712
Propylparaben	7175	Click to see CCCOC(=O)C1=CC=C(C=C1)O	180.20	unknown	https://doi.org/10.1021/JF0258712
> Benzenoids / Benzene and substituted derivatives / Diphenylmethanes
1-[3-[(3-Acetyl-2,4-dihydroxy-6-methoxy-5-methylphenyl)methyl]-2,4,6-trihydroxy-5-(3-methyl-2-butenyl)phenyl]-1-butanone	5315573	Click to see CCCC(=O)C1=C(C(=C(C(=C1O)CC2=C(C(=C(C(=C2O)C(=O)C)O)C)OC)O)CC=C(C)C)O	472.50	unknown	via CMAUP database
Mallotojaponin	122659	Click to see CC1=C(C(=C(C(=C1OC)CC2=C(C(=C(C(=C2O)CC=C(C)C)O)C(=O)C)O)O)C(=O)C)O	444.50	unknown	via CMAUP database
Mallotophenone	179090	Click to see CC1=C(C(=C(C(=C1OC)CC2=C(C(=C(C(=C2O)C(=O)C)O)C)OC)O)C(=O)C)O	404.40	unknown	via CMAUP database
> Hydrocarbons / Saturated hydrocarbons / Alkanes
Pentane	8003	Click to see CCCCC	72.15	unknown	via CMAUP database
Tetracontane	20149	Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	563.10	unknown	via CMAUP database
> Lignans, neolignans and related compounds / Furanoid lignans / Tetrahydrofuran lignans / 9,9-epoxylignans / Dibenzylbutyrolactone lignans
3-[(4-Hydroxy-3,5-dimethoxyphenyl)methyl]-4-[[4-[4-[[4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-5-oxooxolan-3-yl]methyl]-2-methoxyphenyl]-3-methoxyphenyl]methyl]oxolan-2-one	46173975	Click to see COC1=CC(=CC(=C1O)OC)CC2C(COC2=O)CC3=CC(=C(C=C3)C4=C(C=C(C=C4)CC5COC(=O)C5CC6=CC(=C(C(=C6)OC)O)OC)OC)OC	742.80	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters
(2-Pentadecyl-1,3-dioxolan-4-yl)methyl palmitate	631084	Click to see CCCCCCCCCCCCCCCC1OCC(O1)COC(=O)CCCCCCCCCCCCCCC	552.90	unknown	via CMAUP database
Monoethyl fumarate	5358902	Click to see CCOC(=O)C=CC(=O)O	144.12	unknown	via CMAUP database
Stearic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester	633404	Click to see CCCCCCCCCCCCCCCCCC(=O)OCC1COC(O1)(C)C	398.60	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters
(Z)-9-Hexadecenoic acid, methyl ester	5352982	Click to see CCCCCCC=CCCCCCCC(=O)OC	254.41	unknown	via CMAUP database
9-hexadecenoic acid, methyl ester, (9Z)-	14258	Click to see CCCCCCC=CCCCCCCCC(=O)OC	268.40	unknown	via CMAUP database
methyl (E)-octadec-10-enoate	5364425	Click to see CCCCCCCC=CCCCCCCCCC(=O)OC	296.50	unknown	via CMAUP database
Methyl 10-octadecenoate	25642	Click to see CCCCCCCC=CCCCCCCCCC(=O)OC	296.50	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4163420/
Methyl arachidate	14259	Click to see CCCCCCCCCCCCCCCCCCCC(=O)OC	326.60	unknown	via CMAUP database
Methyl cis-10-Octadecenoate	12830109	Click to see CCCCCCCC=CCCCCCCCCC(=O)OC	296.50	unknown	via CMAUP database
Methyl heptadecanoate	15609	Click to see CCCCCCCCCCCCCCCCC(=O)OC	284.50	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4163420/
Methyl palmitate	8181	Click to see CCCCCCCCCCCCCCCC(=O)OC	270.50	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4163420/
Methyl palmitelaidate	638303	Click to see CCCCCCC=CCCCCCCCC(=O)OC	268.40	unknown	via CMAUP database
Methyl palmitoleate	643801	Click to see CCCCCCC=CCCCCCCCC(=O)OC	268.40	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4163420/
Methyl Stearate	8201	Click to see CCCCCCCCCCCCCCCCCC(=O)OC	298.50	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4163420/
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Carbocyclic fatty acids
3-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]propanoic acid	44577211	Click to see CC12CCC(C(C1CCC(=C)C2CCC(=O)O)(C)CO)O	296.40	unknown	https://doi.org/10.1021/NP0704452
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
9-Hexadecenoic acid	5282745	Click to see CCCCCCC=CCCCCCCCC(=O)O	254.41	unknown	via CMAUP database
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
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides
Rhodiocyanoside A	6442274	Click to see CC(=CCOC1C(C(C(C(O1)CO)O)O)O)C#N	259.26	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
Methyl linoleate	5284421	Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC	294.50	unknown	via CMAUP database
Methyl linolelaidate	5362793	Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC	294.50	unknown	via CMAUP database
Methyl linolenate	5319706	Click to see CCC=CCC=CCC=CCCCCCCCC(=O)OC	292.50	unknown	via CMAUP database
Methyl octadeca-9,12-dienoate	8203	Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC	294.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Glycerolipids / Monoradylglycerols / Monoacylglycerols / 1-monoacylglycerols
Glyceryl monooleate	5283468	Click to see CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)O	356.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
(Z)-2-[(E)-2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]but-2-enedioic acid	162873187	Click to see CC12CCC(C(C1CCC(=C)C2C=CC(=CC(=O)O)C(=O)O)(C)CO)O	364.40	unknown	https://doi.org/10.1248/CPB.55.455
(Z)-2-[2-[(1R,4aR,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-4-hydroxybut-2-enoic acid	163089791	Click to see CC12CCC(C(C1CCC(=C)C2CCC(=CCO)C(=O)O)(C)CO)O	352.50	unknown	https://doi.org/10.1002/HLCA.200690237
(Z)-2-[2-[(1R,4aR,5R,8aS)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]but-2-ene-1,4-diol	163016063	Click to see CC1(CCCC2(C1CCC(=C)C2CCC(=CCO)CO)C)CO	322.50	unknown	https://doi.org/10.1002/HLCA.200690237
(Z)-2-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-4-hydroxybut-2-enoic acid	44577209	Click to see CC12CCC(C(C1CCC(=C)C2CCC(=CCO)C(=O)O)(C)CO)O	352.50	unknown	https://doi.org/10.1021/NP0704452
(Z)-2-[2-[(1R,4aS,5R,8aS)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]but-2-ene-1,4-diol	44577208	Click to see CC1(CCCC2(C1CCC(=C)C2CCC(=CCO)CO)C)CO	322.50	unknown	https://doi.org/10.1021/NP0704452
2-[2-[5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]but-2-ene-1,4-diol	74024587	Click to see CC1(CCCC2(C1CCC(=C)C2CCC(=CCO)CO)C)CO	322.50	unknown	https://doi.org/10.1002/HLCA.200690237
2-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]but-2-enedioic acid	162873186	Click to see CC12CCC(C(C1CCC(=C)C2C=CC(=CC(=O)O)C(=O)O)(C)CO)O	364.40	unknown	https://doi.org/10.1248/CPB.55.455
4-hydroxy-2-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]but-2-enoic acid	75049642	Click to see CC12CCC(C(C1CCC(=C)C2CCC(=CCO)C(=O)O)(C)CO)O	352.50	unknown	https://doi.org/10.1002/HLCA.200690237
Andrographic acid	16215024	Click to see CC12CCC(C(C1CCC(=C)C2C=CC(=CC(=O)O)C(=O)O)(C)CO)O	364.40	unknown	https://doi.org/10.1248/CPB.55.455
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids
(E)-(7R,11R)-3,7,11,15-tetramethylhexadec-2-ene-1-ol	145386	Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C	296.50	unknown	via CMAUP database
3,7,11,15-Tetramethyl-2-hexadecen-1-OL	5366244	Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C	296.50	unknown	via CMAUP database
Benzoicacidcyanomethylester	5320547	Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C	296.50	unknown	via CMAUP database
cis-Phytol	6430833	Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C	296.50	unknown	via CMAUP database
Phytol	5280435	Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C	296.50	unknown	via CMAUP database
Phytol [FHFI]	9018	Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C	296.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Polyprenols
(2Z,6Z,10Z,14Z,18Z,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-ol	12442866	Click to see CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C)C)C)C	631.10	unknown	via CMAUP database
(2Z,6Z,10Z,14Z,18Z,22Z,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-ol	12866490	Click to see CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C)C)C)C)C	699.20	unknown	via CMAUP database
(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E,42E)-3,7,11,15,19,23,27,31,35,39,43,47-dodecamethyloctatetraconta-2,6,10,14,18,22,26,30,34,38,42,46-dodecaen-1-ol	14380582	Click to see CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C)C)C)C)C)C)C	835.40	unknown	via CMAUP database
3,7,11,15,19,23,27,31,35-Nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-ol	83218	Click to see CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C)C)C)C	631.10	unknown	via CMAUP database
Ficaprenol 11	11411688	Click to see CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C)C)C)C)C)C	767.30	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
Bisabolene	62346	Click to see CC1=CCC(=C(C)CCC=C(C)C)CC1	204.35	unknown	https://doi.org/10.1039/C39760000105
gamma-Bisabolene, (Z)-	3033866	Click to see CC1=CCC(=C(C)CCC=C(C)C)CC1	204.35	unknown	https://doi.org/10.1039/C39760000105 https://doi.org/10.1139/V84-355
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Diterpene glycosides
[(2R,3S,4S,5R,6S)-6-[[(1R,4aS,5R,8aS)-1,4a-dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methyl acetate	163092982	Click to see CC(=O)OCC1C(C(C(C(O1)OCC2(CCCC3(C2CCC(=C)C3CCC4=CCOC4=O)C)C)O)O)O	522.60	unknown	https://doi.org/10.1248/CPB.42.1216
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1R,4aS,5R,8aR)-1,4a-dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate	124708191	Click to see CC12CCCC(C1CCC(=C)C2CCC3=CCOC3=O)(C)C(=O)OC4C(C(C(C(O4)CO)O)O)O	494.60	unknown	https://doi.org/10.1002/HLCA.200690237
[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 5-[5-hydroxy-3-(hydroxymethyl)pent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate	72997528	Click to see CC12CCCC(C1CCC(=C)C2CCC(=CCO)CO)(C)C(=O)OC3C(C(C(C(O3)CO)O)O)O	498.60	unknown	https://doi.org/10.1021/NP050160U
[6-[[1,4a-dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methyl acetate	85261364	Click to see CC(=O)OCC1C(C(C(C(O1)OCC2(CCCC3(C2CCC(=C)C3CCC4=CCOC4=O)C)C)O)O)O	522.60	unknown	https://doi.org/10.1248/CPB.42.1216
14-Deoxy-11,12-didehydroandrographiside	44575271	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	494.60	unknown	https://doi.org/10.1021/NP050160U
19-[(beta-D-glucopyrasyl)oxy]-	72748779	Click to see CC12CCCC(C1CCC(=C)C2CCC3=CCOC3=O)(C)C(=O)OC4C(C(C(C(O4)CO)O)O)O	494.60	unknown	https://doi.org/10.1002/HLCA.200690237
4-[(E)-2-[(1R,4aR,5R,6R,8aR)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one	162893115	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	494.60	unknown	https://doi.org/10.1002/HLCA.200690237
4-[2-[(1R,4aR,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	162995938	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	496.60	unknown	https://doi.org/10.1002/HLCA.200690237
4-[2-[(1R,4aR,5R,8aS)-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	162925346	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)COC4C(C(C(C(O4)CO)O)O)O	480.60	unknown	https://doi.org/10.1002/HLCA.200690237
4-[2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	159540882	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	496.60	unknown	https://doi.org/10.1248/CPB.32.2117
4-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	162995940	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	496.60	unknown	https://doi.org/10.1248/CPB.42.1216
4-[2-[(1R,4aS,5R,8aS)-5-[[(2R,3R,4S,5S,6R)-3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	44575258	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)COC4C(C(C(C(O4)CO)O)O)OC5C(C(CO5)(CO)O)O	612.70	unknown	https://doi.org/10.1021/NP050160U
4-[2-[(1R,4aS,5R,8aS)-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	154497075	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)COC4C(C(C(C(O4)CO)O)O)O	480.60	unknown	https://doi.org/10.1016/S0040-4020(01)90763-X
4-[2-[(1R,4aS,5R,8aS)-5,8a-dimethyl-2-methylidene-5-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	6325727	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)COC4C(C(C(C(O4)CO)O)O)O	480.60	unknown	https://doi.org/10.1016/S0040-4020(01)90763-X https://doi.org/10.1093/CHROMSCI/BMT157 https://doi.org/10.1021/NP050160U https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1021/NP0704452
4-[2-[(1R,4aS,6R,8aS)-5,5,8a-trimethyl-2-methylidene-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	11576609	Click to see CC1(C2CCC(=C)C(C2(CCC1OC3C(C(C(C(O3)CO)O)O)O)C)CCC4=CCOC4=O)C	480.60	unknown	https://doi.org/10.1021/NP050160U
4-[2-[(1R,5R,8aS)-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	24980083	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)COC4C(C(C(C(O4)CO)O)O)O	480.60	unknown	via CMAUP database
4-[2-[5-[[3-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	73008216	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)COC4C(C(C(C(O4)CO)O)O)OC5C(C(CO5)(CO)O)O	612.70	unknown	https://doi.org/10.1021/NP050160U
4-[2-[5,5,8a-trimethyl-2-methylidene-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	73016961	Click to see CC1(C2CCC(=C)C(C2(CCC1OC3C(C(C(C(O3)CO)O)O)O)C)CCC4=CCOC4=O)C	480.60	unknown	https://doi.org/10.1021/NP050160U
4-[2-[5,8a-dimethyl-2-methylidene-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	4662580	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)COC4C(C(C(C(O4)CO)O)O)O	480.60	unknown	https://doi.org/10.1248/BPB.25.1169 https://doi.org/10.1038/169033C0 https://doi.org/10.1002/CHIN.201029197 https://doi.org/10.1016/S0040-4020(01)90763-X https://doi.org/10.1055/S-2007-967181 https://doi.org/10.1021/NP050211N https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1039/P19730001247 https://doi.org/10.1002/HLCA.200690237 https://doi.org/10.1039/P29900001011 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1021/JF025556F https://doi.org/10.1021/NP050160U
4-[2-[6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one	75048859	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	494.60	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1002/HLCA.200690237
4-[2-[6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	75048858	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	496.60	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1021/NP050211N https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1002/HLCA.200690237 https://doi.org/10.1002/CHIN.201029197
Andrographatoside	11533372	Click to see CC12CCCC(C1CCC(=C)C2CCC(=CCO)CO)(C)C(=O)OC3C(C(C(C(O3)CO)O)O)O	498.60	unknown	https://doi.org/10.1021/NP050160U
Andropanoside	44575270	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	496.60	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1248/CPB.32.2117 https://doi.org/10.1021/NP050211N https://doi.org/10.1002/CHIN.201029197
Neoandrogra-pholide	45358137	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)COC4C(C(C(C(O4)CO)O)O)O	480.60	unknown	via CMAUP database
Neoandrographolide	9848024	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)COC4C(C(C(C(O4)CO)O)O)O	480.60	unknown	https://doi.org/10.3109/13880209209054010 https://doi.org/10.1039/P29900001011 https://doi.org/10.1016/0006-2952(93)90364-3 https://doi.org/10.1055/S-2007-967181 https://doi.org/10.1021/JF025556F https://doi.org/10.1016/S0021-9673(01)01160-8 https://doi.org/10.1016/S0040-4020(01)90763-X https://doi.org/10.1002/PCA.644 https://doi.org/10.1002/CHIN.201029197 https://doi.org/10.1002/(SICI)1099-1565(200001/02)11:1<34::AID-PCA487>3.0.CO;2-V https://doi.org/10.1021/NP050211N https://doi.org/10.1016/S0731-7085(99)00297-6 https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1076/PHBI.36.1.72.4620 https://doi.org/10.1021/NP050160U https://doi.org/10.1021/NP0704452 https://doi.org/10.3109/13880209009082833 https://doi.org/10.1080/10286020701273627 https://doi.org/10.1021/NP50097A002 https://doi.org/10.1038/169033C0 https://doi.org/10.1248/BPB.25.1169 https://doi.org/10.1016/S0031-9422(03)00051-7 https://doi.org/10.1248/CPB.32.2117 https://doi.org/10.1039/P19730001247 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
Germacra-1(10),4,11(13)-triene-12,14-dioic acid, 2-beta,6-alpha,8-alpha-trihydroxy-, 12,6:14,2-dilactone, methacrylate, (E)-	6381428	Click to see CC1=CC2C(C(CC3=CC(C1)OC3=O)OC(=O)C(=C)C)C(=C)C(=O)O2	344.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones
(2R)-4-[(E)-2-[(1R,4aR,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2-methoxy-2H-furan-5-one	162943189	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CC(OC3=O)OC)(C)CO)O	362.50	unknown	https://doi.org/10.1002/HLCA.200690237
(2R)-4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2-[(1S)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-(5-oxo-2H-furan-4-yl)ethyl]-2H-furan-5-one	124519254	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C=C(C(=O)O3)C=CC4C(=C)CCC5C4(CCC(C5(C)CO)O)C)C6=CCOC6=O)(C)CO)O	664.90	unknown	https://doi.org/10.1248/CPB.42.1216
(2S)-4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2-[2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-(5-oxo-2H-furan-4-yl)ethyl]-2H-furan-5-one	139600355	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C=C(C(=O)O3)C=CC4C(=C)CCC5C4(CCC(C5(C)CO)O)C)C6=CCOC6=O)(C)CO)O	664.90	unknown	https://doi.org/10.1248/CPB.42.1216
(2S)-4-[(E)-2-[(1S,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2-[(1S)-2-[(1S,4aR,5S,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-(4-oxofuran-3-yl)ethyl]-2H-furan-5-one	154497766	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C=C(C(=O)O3)C=CC4C(=C)CCC5C4(CCC(C5(C)CO)O)C)C6=COCC6=O)(C)CO)O	664.90	unknown	https://doi.org/10.1021/NP050160U
(3R,4S)-3-[(1R)-2-[(1R,4aS,5S,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-hydroxyethyl]-4-hydroxyoxolan-2-one	162850870	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C(COC3=O)O)O)(C)CO)O	368.50	unknown	https://doi.org/10.1021/NP0704452
(3R,4S)-3-[(1S)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-hydroxyethyl]-4-hydroxyoxolan-2-one	154495952	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C(COC3=O)O)O)(C)CO)O	368.50	unknown	https://doi.org/10.1021/NP050160U
(3R,4S)-3-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-4-hydroxyoxolan-2-one	29927575	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3C(COC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/JF903629J
(3S,4S)-3-[(1R)-2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-hydroxyethyl]-4-hydroxyoxolan-2-one	162850872	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C(COC3=O)O)O)(C)CO)O	368.50	unknown	https://doi.org/10.1021/NP050160U
(3S,4S)-3-[(1R)-2-[(1R,4aS,5S,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-hydroxyethyl]-4-hydroxyoxolan-2-one	162850869	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C(COC3=O)O)O)(C)CO)O	368.50	unknown	https://doi.org/10.1021/NP0704452
(3S,4S)-3-[(E)-2-[(1S,4aR,5S,6S,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-3,4-dihydroxyoxolan-2-one	163187150	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3(C(COC3=O)O)O)(C)CO)O	366.40	unknown	https://doi.org/10.1016/J.FITOTE.2010.03.003
(3S,4S)-3-[2-[(1S,4aR,5S,6S,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-3,4-dihydroxyoxolan-2-one	162940935	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3(C(COC3=O)O)O)(C)CO)O	366.40	unknown	https://doi.org/10.1016/J.FITOTE.2010.03.003
(4S)-3-[(E)-2-[(4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-4-hydroxyoxolan-2-one	45358107	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3C(COC3=O)O)(C)CO)O	350.40	unknown	via CMAUP database
[(1R,2R,4aR,5R,8aS)-1,4a-dimethyl-6-methylidene-5-[(E)-2-[(5E)-5-[(2E,7E)-2-methylnona-2,7-dienylidene]-2-oxofuran-3-yl]ethenyl]-2-(pyridine-3-carbonyloxy)-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl pyridine-3-carboxylate	44437487	Click to see CC=CCCCC=C(C)C=C1C=C(C(=O)O1)C=CC2C(=C)CCC3C2(CCC(C3(C)COC(=O)C4=CN=CC=C4)OC(=O)C5=CN=CC=C5)C	676.80	unknown	via CMAUP database
[2-hydroxy-1,4a-dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethenyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl acetate	75164174	Click to see CC(=O)OCC1(C2CCC(=C)C(C2(CCC1O)C)C=CC3=CCOC3=O)C	374.50	unknown	https://doi.org/10.1021/JF903629J
12R,13R-Hydroxyandrographilide	24879277	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C(COC3=O)O)O)(C)CO)O	368.50	unknown	https://doi.org/10.1021/NP0704452
12S-hydroxyandrographolide	44575259	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C(COC3=O)O)O)(C)CO)O	368.50	unknown	via CMAUP database
12S,13S-Hydroxyandrographilide	24879274	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C(COC3=O)O)O)(C)CO)O	368.50	unknown	https://doi.org/10.1021/NP0704452
14-Deoxy-11-hydroxyandrographolide	91884987	Click to see CC12CCC(C(C1CCC(=C)C2C(CC3=CCOC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1021/NP050160U https://doi.org/10.1248/CPB.42.1216
14-Deoxy-11-oxoandrographolide	9975052	Click to see CC12CCC(C(C1CCC(=C)C2C(=O)CC3=CCOC3=O)(C)CO)O	348.40	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1039/P19730001247 https://doi.org/10.1002/CHIN.201029197
14-Deoxy-11,12-didehydroandrographolide	5708351	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO)O	332.40	unknown	https://doi.org/10.1021/NP0704452 https://doi.org/10.1021/JF903629J https://doi.org/10.1002/CHIN.201029197 https://doi.org/10.1055/S-2007-967181 https://doi.org/10.1021/NP050211N https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1039/P19730001247 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1021/NP050160U
14-Deoxy-12-hydroxyandrographolide	38350572	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3=CCOC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1248/CPB.42.1216
14-Deoxy-12-methoxyandrographolide	10473975	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3=CCOC3=O)OC)(C)CO)O	364.50	unknown	https://doi.org/10.1248/CPB.32.2117 https://doi.org/10.1248/CPB.42.1216
14-Deoxy-15-isopropylidene-11,12-didehydroandrographolide	637300	Click to see CC(=C1C=C(C(=O)O1)C=CC2C(=C)CCC3C2(CCC(C3(C)CO)O)C)C	372.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1016/S0031-9422(03)00051-7
14-Deoxy-17-hydroxyandrographolide	11631693	Click to see CC12CCC(C(C1CCC(C2CCC3=CCOC3=O)CO)(C)CO)O	352.50	unknown	https://doi.org/10.1021/NP050160U
14-Deoxyandrographolide	11624161	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(C)CO)O	334.40	unknown	https://doi.org/10.1021/NP0704452 https://doi.org/10.1080/10286020701273627 https://doi.org/10.3109/13880209009082833 https://doi.org/10.1002/CHIN.201029197 https://doi.org/10.1248/CPB.32.2117 https://doi.org/10.1021/NP050211N https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1039/P29900001011 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1021/NP050160U https://doi.org/10.1016/J.JEP.2004.03.004
19-Hydroxy-8(17),13-labdadien-16,15-olide	45934420	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)CO	318.40	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1016/J.FITOTE.2010.03.003 https://doi.org/10.1021/NP050211N https://doi.org/10.1002/HLCA.200690237 https://doi.org/10.1002/CHIN.201029197
19-O-Acetyl-14-deoxy-11,12-didehydroandrographolide	46179874	Click to see CC(=O)OCC1(C2CCC(=C)C(C2(CCC1O)C)C=CC3=CCOC3=O)C	374.50	unknown	https://doi.org/10.1021/JF903629J
2(5H)-Furanone, 3-[2-[decahydro-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]ethyl]-	343586	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(C)CO)O	334.40	unknown	https://doi.org/10.1021/NP0704452 https://doi.org/10.1002/CHIN.201029197 https://doi.org/10.1021/NP050211N https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1039/P29900001011 https://doi.org/10.1002/HLCA.200690237 https://doi.org/10.1039/P19730001247 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1021/NP050160U
3-(1-Hydroxy-2-(6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylenedecahydro-1-naphthalenyl)ethyl)-2(5H)-furanone	363866	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3=CCOC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1002/CHIN.201029197
3-[2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-oxoethyl]-2H-furan-5-one	101593061	Click to see CC12CCC(C(C1CCC(=C)C2C(=O)CC3=CC(=O)OC3)(C)CO)O	348.40	unknown	via CMAUP database
3-{2-[6-Hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidenedecahydronaphthalen-1-yl]ethenyl}furan-2(5H)-one	6051497	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO)O	332.40	unknown	via CMAUP database
4-[(1R)-2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-hydroxyethyl]-2H-furan-5-one	38350563	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3=CCOC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1002/CHIN.201029197
4-[(1R)-2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-methoxyethyl]-2H-furan-5-one	162936735	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3=CCOC3=O)OC)(C)CO)O	364.50	unknown	https://doi.org/10.1021/NP050160U
4-[(1S)-2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-methoxyethyl]-2H-furan-5-one	162936734	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3=CCOC3=O)OC)(C)CO)O	364.50	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1248/CPB.42.1216
4-[(2R,3aR,5aS,6R,7R,9aR,9bS)-7-hydroxy-6-(hydroxymethyl)-3a,6,9a-trimethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran-2-yl]-2H-furan-5-one	101563020	Click to see CC12CCC(C(C1CCC3(C2CC(O3)C4=CCOC4=O)C)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050211N https://doi.org/10.1002/HLCA.201100236
4-[(2R,3aS,5aS,6R,7R,9aR,9bS)-7-hydroxy-6-(hydroxymethyl)-3a,6,9a-trimethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran-2-yl]-2H-furan-5-one	101563019	Click to see CC12CCC(C(C1CCC3(C2CC(O3)C4=CCOC4=O)C)(C)CO)O	350.40	unknown	https://doi.org/10.1002/HLCA.201100236
4-[(2S,3aR,5aS,6R,7R,9aR,9bS)-7-hydroxy-6-(hydroxymethyl)-3a,6,9a-trimethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran-2-yl]-2H-furan-5-one	101563021	Click to see CC12CCC(C(C1CCC3(C2CC(O3)C4=CCOC4=O)C)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050211N https://doi.org/10.1002/HLCA.201100236
4-[(2S,3aS,5aS,6R,7R,9aR,9bS)-7-hydroxy-6-(hydroxymethyl)-3a,6,9a-trimethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran-2-yl]-2H-furan-5-one	101563018	Click to see CC12CCC(C(C1CCC3(C2CC(O3)C4=CCOC4=O)C)(C)CO)O	350.40	unknown	https://doi.org/10.1002/HLCA.201100236
4-[(E)-2-[(1R,4aR,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one	7091237	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO)O	332.40	unknown	https://doi.org/10.1002/HLCA.200690237
4-[(E)-2-[(1R,4aR,5R,8aR)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-6-oxo-1,3,4,4a,7,8-hexahydronaphthalen-1-yl]ethenyl]-2H-furan-5-one	163032487	Click to see CC12CCC(=O)C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO	330.40	unknown	https://doi.org/10.1002/HLCA.200690237
4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2-methoxy-2H-furan-5-one	44577207	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CC(OC3=O)OC)(C)CO)O	362.50	unknown	https://doi.org/10.1021/NP0704452
4-[(E)-2-[(1R,4aS,5R,8aR)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-6-oxo-1,3,4,4a,7,8-hexahydronaphthalen-1-yl]ethenyl]-2H-furan-5-one	44577191	Click to see CC12CCC(=O)C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO	330.40	unknown	https://doi.org/10.1021/NP0704452
4-[(E)-2-[(1R,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-decalin-1-yl]vinyl]-2H-furan-5-one	9905648	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO)O	332.40	unknown	via CMAUP database
4-[(E)-2-[(1S,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one	7091238	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO)O	332.40	unknown	https://doi.org/10.1039/P29900001011
4-[(E)-2-[(4aS,5R)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one	5316432	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO)O	332.40	unknown	https://doi.org/10.3736/JCIM20040618
4-[2-[(1R,4aR,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	15922991	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(C)CO)O	334.40	unknown	https://doi.org/10.1002/HLCA.200690237
4-[2-[(1R,4aR,5R,8aS)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	38356709	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)CO	318.40	unknown	https://doi.org/10.1002/HLCA.200690237
4-[2-[(1R,4aR,6R,8aS)-6-hydroxy-5,5-bis(hydroxymethyl)-8a-methyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	162880770	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(CO)CO)O	350.40	unknown	https://doi.org/10.1002/HLCA.200690237
4-[2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one	2772111	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO)O	332.40	unknown	via CMAUP database
4-[2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	100956485	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(C)CO)O	334.40	unknown	https://doi.org/10.1039/P19730001247
4-[2-[(1R,4aS,5R,8aS)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-6-oxo-1,3,4,4a,7,8-hexahydronaphthalen-1-yl]ethyl]-2H-furan-5-one	44577190	Click to see CC12CCC(=O)C(C1CCC(=C)C2CCC3=CCOC3=O)(C)CO	332.40	unknown	https://doi.org/10.1021/NP0704452
4-[2-[(1S,2R,4aS,5R,6R,8aR)-6-hydroxy-2,5-bis(hydroxymethyl)-2-methoxy-5,8a-dimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	57402304	Click to see CC12CCC(C(C1CCC(C2CCC3=CCOC3=O)(CO)OC)(C)CO)O	382.50	unknown	https://doi.org/10.1016/J.CCLET.2010.01.019
4-[2-[(1S,2R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethylspiro[3,4,4a,6,7,8-hexahydro-1H-naphthalene-2,2'-oxirane]-1-yl]ethyl]-2H-furan-5-one	44575263	Click to see CC12CCC(C(C1CCC3(C2CCC4=CCOC4=O)CO3)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050160U
4-[2-[(1S,3R,4aS,5R,6R,8aR)-3,6-dihydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	163006147	Click to see CC12CCC(C(C1CC(C(=C)C2CCC3=CCOC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP0704452
4-[2-[(1S,3R,4aS,5R,6R,8aS)-3,6-dihydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	24879275	Click to see CC12CCC(C(C1CC(C(=C)C2CCC3=CCOC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP0704452
4-[2-[(1S,3S,4aS,5R,6R,8aR)-3,6-dihydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	163006146	Click to see CC12CCC(C(C1CC(C(=C)C2CCC3=CCOC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP0704452
4-[2-[(1S,3S,4aS,5R,6R,8aS)-3,6-dihydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	24879276	Click to see CC12CCC(C(C1CC(C(=C)C2CCC3=CCOC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP0704452
4-[2-[(1S,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	124708053	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(C)CO)O	334.40	unknown	https://doi.org/10.1039/P19730001247
4-[2-[(4aS,5R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-hydroxyethyl]-2H-furan-5-one	137795372	Click to see CC12CCC(C(C1CCC(=C)C2C(CC3=CCOC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1248/CPB.42.1216
4-[2-[3,6-dihydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	74342729	Click to see CC12CCC(C(C1CC(C(=C)C2CCC3=CCOC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP0704452
4-[2-[5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-6-oxo-1,3,4,4a,7,8-hexahydronaphthalen-1-yl]ethenyl]-2H-furan-5-one	74371699	Click to see CC12CCC(=O)C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO	330.40	unknown	https://doi.org/10.1002/HLCA.200690237
4-[2-[6-hydroxy-2,5-bis(hydroxymethyl)-2-methoxy-5,8a-dimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	76523775	Click to see CC12CCC(C(C1CCC(C2CCC3=CCOC3=O)(CO)OC)(C)CO)O	382.50	unknown	https://doi.org/10.1016/J.CCLET.2010.01.019
4-[2-[6-hydroxy-2,5-bis(hydroxymethyl)-5,8a-dimethyl-1,2,3,4,4a,6,7,8-octahydronaphthalen-1-yl]ethyl]-2H-furan-5-one	73035890	Click to see CC12CCC(C(C1CCC(C2CCC3=CCOC3=O)CO)(C)CO)O	352.50	unknown	https://doi.org/10.1021/NP050160U
4-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-methoxyethyl]-2H-furan-5-one	20592914	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3=CCOC3=O)OC)(C)CO)O	364.50	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1248/CPB.42.1216
4-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-oxoethyl]-2H-furan-5-one	5316570	Click to see CC12CCC(C(C1CCC(=C)C2C(=O)CC3=CCOC3=O)(C)CO)O	348.40	unknown	https://doi.org/10.1021/NP050160U https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270826/ https://doi.org/10.1039/P19730001247 https://doi.org/10.1002/CHIN.201029197
4-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2-methoxy-2H-furan-5-one	75049641	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CC(OC3=O)OC)(C)CO)O	362.50	unknown	https://doi.org/10.1002/HLCA.200690237
4-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one	4262071	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)CO)O	332.40	unknown	https://doi.org/10.1021/JF903629J https://doi.org/10.1002/CHIN.201029197 https://doi.org/10.1055/S-2007-967181 https://doi.org/10.1021/NP050211N https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1039/P19730001247 https://doi.org/10.1002/HLCA.200690237 https://doi.org/10.1039/P29900001011 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1021/NP050160U
4-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethylspiro[3,4,4a,6,7,8-hexahydro-1H-naphthalene-2,2'-oxirane]-1-yl]ethyl]-2H-furan-5-one	75048854	Click to see CC12CCC(C(C1CCC3(C2CCC4=CCOC4=O)CO3)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050160U
4-[2-[6-hydroxy-5,5-bis(hydroxymethyl)-8a-methyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	162880769	Click to see CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(CO)CO)O	350.40	unknown	https://doi.org/10.1002/HLCA.200690237
4-[2-hydroxy-2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one	73074617	Click to see CC12CCC(C(C1CCC(=C)C2C(CC3=CCOC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1021/NP050160U https://doi.org/10.1248/CPB.42.1216
4-[7-hydroxy-6-(hydroxymethyl)-3a,6,9a-trimethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran-2-yl]-2H-furan-5-one	162958281	Click to see CC12CCC(C(C1CCC3(C2CC(O3)C4=CCOC4=O)C)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050211N https://doi.org/10.1002/HLCA.201100236
4-hydroxy-3-[1-hydroxy-2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]oxolan-2-one	73007025	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C(COC3=O)O)O)(C)CO)O	368.50	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1021/NP0704452
4-hydroxy-3-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]oxolan-2-one	74600971	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3C(COC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/JF903629J
Andrograpanin	11666871	Click to see CC1(CCCC2(C1CCC(=C)C2CCC3=CCOC3=O)C)CO	318.40	unknown	https://doi.org/10.1016/J.FITOTE.2010.03.003 https://doi.org/10.1021/NP050160U https://doi.org/10.1248/CPB.32.2117 https://doi.org/10.1021/NP050211N https://doi.org/10.1002/CHIN.201029197 https://doi.org/10.1021/NP0704452
Bisandrographolide	12000062	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C=C(C(=O)O3)C=CC4C(=C)CCC5C4(CCC(C5(C)CO)O)C)C6=CCOC6=O)(C)CO)O	664.90	unknown	https://doi.org/10.1248/CPB.42.1216
Bisandrographolide C	73174172	Click to see CC12CCC(C(C1CCC(=C)C2CC(C3C=C(C(=O)O3)C=CC4C(=C)CCC5C4(CCC(C5(C)CO)O)C)C6=CCOC6=O)(C)CO)O	664.90	unknown	https://doi.org/10.1248/CPB.42.1216
Dehydroandrographolide succinate	6540717	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)COC(=O)CCC(=O)O)OC(=O)CCC(=O)O	532.60	unknown	via CMAUP database
Dehydroandrograpolide Succinate	11854372	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)COC(=O)CCC(=O)O)OC(=O)CCC(=O)O	532.60	unknown	via CMAUP database
Deoxyandrographolide	21679042	Click to see CC1=C(C2(CCC(C(C2CC1)(C)CO)O)C)CCC3=CCOC3=O	334.40	unknown	https://doi.org/10.1002/PCA.644 https://doi.org/10.1016/S0021-9673(01)01160-8 https://doi.org/10.1016/S0944-7113(97)80002-5 https://doi.org/10.1080/10286020701273627 https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.3109/13880209209054010
methyl (2E,5S)-6-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-oxo-5-(5-oxo-2H-furan-4-yl)hexanoate	163047567	Click to see CC12CCC(C(C1CCC(=C)C2CC=C(CC(=O)C(CC3C(=C)CCC4C3(CCC(C4(C)CO)O)C)C5=CCOC5=O)C(=O)OC)(C)CO)O	696.90	unknown	https://doi.org/10.1248/CPB.42.1216
methyl (2E)-6-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-oxo-5-(5-oxo-2H-furan-4-yl)hexanoate	102077295	Click to see CC12CCC(C(C1CCC(=C)C2CC=C(CC(=O)C(CC3C(=C)CCC4C3(CCC(C4(C)CO)O)C)C5=CCOC5=O)C(=O)OC)(C)CO)O	696.90	unknown	https://doi.org/10.1248/CPB.42.1216
methyl 6-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-oxo-5-(5-oxo-2H-furan-4-yl)hexanoate	85143594	Click to see CC12CCC(C(C1CCC(=C)C2CC=C(CC(=O)C(CC3C(=C)CCC4C3(CCC(C4(C)CO)O)C)C5=CCOC5=O)C(=O)OC)(C)CO)O	696.90	unknown	https://doi.org/10.1248/CPB.42.1216
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(23S,25S)-5alpha-Spirostane-3beta,6alpha,23-triol	637463	Click to see CC1CC(C2(C(C3C(O2)CC4C3(CCC5C4CC(C6C5(CCC(C6)O)C)O)C)C)OC1)O	448.60	unknown	via CMAUP database
bisandrographolide B	44575280	Click to see CC12CCC(C(C1CCC(=C)C2C=CC3=CC(OC3=O)C4(C(=C)CCC5C4(CCC(C5(C)CO)O)C)CCC6=CCOC6=O)(C)CO)O	664.90	unknown	https://doi.org/10.1248/CPB.42.1216
Squalene	638072	Click to see CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C	410.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Androstane steroids / Androgens and derivatives
16-(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	53399246	Click to see CCC(CCC(C)C1CC2C3CC=C4CC(CCC4(C3CCC2(C1)C)C)O)C(C)C	414.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids
5-(5,6-Dimethylhept-3-en-2-yl)-6,10-dimethyl-16,17-dioxapentacyclo[13.2.2.01,9.02,6.010,15]nonadec-18-en-13-ol	633877	Click to see CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C24C=CC5(C3(CCC(C5)O)C)OO4)C	428.60	unknown	https://doi.org/10.1021/JF903629J
Ergosterol peroxide	5351516	Click to see CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C24C=CC5(C3(CCC(C5)O)C)OO4)C	428.60	unknown	https://doi.org/10.1021/JF903629J
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
(3S,8S,9S,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	134766514	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	400.70	unknown	https://doi.org/10.1039/C39850000148
5-Cholestene-3-ol, 24-methyl-	312822	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	400.70	unknown	https://doi.org/10.1039/C39850000148
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid lactones
[(2R,3R,4R,4aS,10bS)-8,10-dihydroxy-2-(hydroxymethyl)-9-methoxy-6-oxo-4-(3,4,5-trihydroxybenzoyl)oxy-3,4,4a,10b-tetrahydro-2H-pyrano[3,2-c]isochromen-3-yl] 3,4,5-trihydroxybenzoate	71571588	Click to see COC1=C(C=C2C(=C1O)C3C(C(C(C(O3)CO)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)OC2=O)O	632.50	unknown	via CMAUP database
[(2R,3R,4S,4aS,10bS)-3,8,10-trihydroxy-9-methoxy-6-oxo-4-(3,4,5-trihydroxybenzoyl)oxy-3,4,4a,10b-tetrahydro-2H-pyrano[3,2-c]isochromen-2-yl]methyl 3,4,5-trihydroxybenzoate	102314951	Click to see COC1=C(C=C2C(=C1O)C3C(C(C(C(O3)COC(=O)C4=CC(=C(C(=C4)O)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)OC2=O)O	632.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
(2S,3R,4S,5R)-2-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-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]oxane-3,4,5-triol	6326040	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(CO5)O)O)O)C)C)C(C)C	546.80	unknown	via CMAUP database
(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
17-(5-ethyl-6-methylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	122544	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	https://doi.org/10.1021/JF903629J
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/10.1021/JF903629J https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1039/C39850000148
24-Ethylcholest-5-en-3beta-ol	22012	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1039/C39850000148
Beta-Sitosterol	222284	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1021/JF903629J https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
Stigmasterol	5280794	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	https://doi.org/10.1039/C39850000148 https://doi.org/10.1021/JF903629J
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
[2-(2,15-dihydroxy-9,9,18-trimethyl-5,14-dioxo-4,8,21-trioxahexacyclo[13.5.1.01,13.03,7.03,10.016,18]henicosan-17-yl)-1-(4-methyl-5-oxo-2H-furan-2-yl)propyl] acetate	73307301	Click to see CC1=CC(OC1=O)C(C(C)C2C3C2(CCC45C(CCC6C(OC7C6(C4O)OC(=O)C7)(C)C)C(=O)C3(O5)O)C)OC(=O)C	588.60	unknown	https://doi.org/10.1016/0006-2952(93)90364-3 https://doi.org/10.1002/(SICI)1099-1565(200001/02)11:1<34::AID-PCA487>3.0.CO;2-V https://doi.org/10.3109/13880209009082833 https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.3109/13880209209054010 https://doi.org/10.1021/NP0704452
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclic alcohols and derivatives
(1R,2R,4aS,5R,8aR)-5-(2-hydroxyethyl)-1-(hydroxymethyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-ol	163029876	Click to see CC12CCC(C(C1CCC(=C)C2CCO)(C)CO)O	268.39	unknown	https://doi.org/10.1002/HLCA.200690237
(E)-3-[(1R,4aR,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]prop-2-enoic acid	163034850	Click to see CC12CCC(C(C1CCC(=C)C2C=CC(=O)O)(C)CO)O	294.40	unknown	https://doi.org/10.1002/HLCA.200690237
(E)-3-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]prop-2-enoic acid	44577210	Click to see CC12CCC(C(C1CCC(=C)C2C=CC(=O)O)(C)CO)O	294.40	unknown	https://doi.org/10.1021/NP0704452
3-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]prop-2-enoic acid	75049643	Click to see CC12CCC(C(C1CCC(=C)C2C=CC(=O)O)(C)CO)O	294.40	unknown	https://doi.org/10.1002/HLCA.200690237
5-(2-hydroxyethyl)-1-(hydroxymethyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-ol	163029875	Click to see CC12CCC(C(C1CCC(=C)C2CCO)(C)CO)O	268.39	unknown	https://doi.org/10.1002/HLCA.200690237
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
3-{[3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid	348159	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	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
4,5-Dicaffeoylquinic acid	5281780	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O	516.40	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	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
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
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Cyanogenic glycosides
Epilotaustralin	185818	Click to see CCC(C)(C#N)OC1C(C(C(C(O1)CO)O)O)O	261.27	unknown	via CMAUP database
Rhodiocyanoside D	6442230	Click to see CC=C(COC1C(C(C(C(O1)CO)O)O)O)C#N	259.26	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
(3E,4S)-3-[2-[(1R,4aS,5R,6R,8aR)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one	163002382	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)OC4C(C(C(C(O4)CO)O)O)O	512.60	unknown	https://doi.org/10.1021/NP050160U
(3E,4S)-3-[2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one	162962973	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	512.60	unknown	https://doi.org/10.1021/NP050160U
(3E,4S)-3-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one	162962972	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	512.60	unknown	https://doi.org/10.1248/CPB.42.1216
(3E,4S)-3-[2-[(1R,4aS,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one	11968631	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	512.60	unknown	via CMAUP database
(3Z,4R)-3-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one	162962969	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	512.60	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
(4E,5R)-4-[2-[(1R,4aR,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-5-hydroxyoxolan-3-one	163045492	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(OCC3=O)O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	512.60	unknown	https://doi.org/10.1002/HLCA.200690237
3-O-beta-D-Glucopyranosylandrographolide	11519131	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)OC4C(C(C(C(O4)CO)O)O)O	512.60	unknown	https://doi.org/10.1021/NP050160U
4-hydroxy-3-[2-[5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]oxolan-2-one	72992318	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)OC4C(C(C(C(O4)CO)O)O)O	512.60	unknown	https://doi.org/10.1021/NP050160U
4-hydroxy-3-[2-[6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]oxolan-2-one	4128470	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	512.60	unknown	https://doi.org/10.1016/J.FITOTE.2010.03.003 https://doi.org/10.1021/NP050160U https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1016/J.MOLSTRUC.2009.11.036 https://doi.org/10.1002/CHIN.201029197
5-hydroxy-4-[2-[6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]oxolan-3-one	163045491	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(OCC3=O)O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	512.60	unknown	https://doi.org/10.1002/HLCA.200690237
Andrographiside	44593583	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	512.60	unknown	https://doi.org/10.1016/J.FITOTE.2010.03.003 https://doi.org/10.1021/NP050160U https://doi.org/10.1016/J.MOLSTRUC.2009.11.036 https://doi.org/10.1002/CHIN.201029197 https://doi.org/10.1021/NP0704452
Andrographoside	6439612	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)COC4C(C(C(C(O4)CO)O)O)O)O	512.60	unknown	https://doi.org/10.1016/0006-2952(93)90364-3 https://doi.org/10.1021/NP050160U https://doi.org/10.1002/(SICI)1099-1565(200001/02)11:1<34::AID-PCA487>3.0.CO;2-V https://doi.org/10.3109/13880209009082833 https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.3109/13880209209054010 https://doi.org/10.1021/NP0704452
Procumbide	21604824	Click to see CC12C3C(OC=CC3(C(C1O2)O)O)OC4C(C(C(C(O4)CO)O)O)O	362.33	unknown	https://doi.org/10.1248/CPB.35.4429
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-2-methoxyphenoxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate	102442447	Click to see COC1=C(C=CC(=C1)O)OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O	454.40	unknown	via CMAUP database
[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-2,6-dimethoxyphenoxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate	25262417	Click to see COC1=CC(=CC(=C1OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O)OC)O	484.40	unknown	via CMAUP database
[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-3-methoxyphenoxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate	102442448	Click to see COC1=C(C=CC(=C1)OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O)O	454.40	unknown	via CMAUP database
4-Hydroxy-3-methoxyphenyl 2-O,6-O-bis(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranoside	102147465	Click to see COC1=C(C=CC(=C1)OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)O	606.50	unknown	via CMAUP database
I(2)-D-Glucopyranoside, 3,4,5-trimethoxyphenyl, 2,6-bis(3,4,5-trihydroxybenzoate)	102469980	Click to see COC1=CC(=CC(=C1OC)OC)OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	650.50	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones
1-(2,6-Dihydroxy-4-methoxy-3-methylphenyl)ethanone	14602300	Click to see CC1=C(C=C(C(=C1O)C(=O)C)O)OC	196.20	unknown	via CMAUP database
Butyrylmallotochromene	189457	Click to see CCCC(=O)C1=C2C(=C(C(=C1O)CC3=C(C(=C(C(=C3O)C(=O)C)O)C)OC)O)C=CC(O2)(C)C	470.50	unknown	via CMAUP database
Isomallotochromene	10433453	Click to see CC1=C(C(=C(C(=C1OC)CC2=C3C(=C(C(=C2O)C(=O)C)O)C=CC(O3)(C)C)O)C(=O)C)O	442.50	unknown	via CMAUP database
Mallophenone	14602301	Click to see CC1=C(C(=C(C(=C1OC)C)O)C(=O)C)O	210.23	unknown	via CMAUP database
Mallotochromene	126969	Click to see CC1=C(C(=C(C(=C1OC)CC2=C(C(=C3C(=C2O)C=CC(O3)(C)C)C(=O)C)O)O)C(=O)C)O	442.50	unknown	via CMAUP database
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Xanthones
Decussatin	5378284	Click to see COC1=C(C2=C(C=C1)OC3=CC(=CC(=C3C2=O)O)OC)OC	302.28	unknown	via CMAUP database
Methylswertianin	5281653	Click to see COC1=C(C2=C(C=C1)OC3=CC(=CC(=C3C2=O)O)OC)O	288.25	unknown	via CMAUP database
> Organoheterocyclic compounds / Diazanaphthalenes / Benzodiazines / Quinazolines
Deoxypeganine	442894	Click to see C1CC2=NC3=CC=CC=C3CN2C1	172.23	unknown	via CMAUP database
> Organoheterocyclic compounds / Dihydrofurans / Furanones
(4E,5R)-4-[2-[(1R,4aR,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-5-hydroxyoxolan-3-one	162849050	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(OCC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1002/HLCA.200690237
5-hydroxy-4-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]oxolan-3-one	162849049	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(OCC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1002/HLCA.200690237
> Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides
(3Z)-3-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]furan-2-one	124461559	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C=COC3=O)(C)CO)O	332.40	unknown	https://doi.org/10.1016/J.FITOTE.2010.03.003
(3Z)-3-[2-[(1S,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]furan-2-one	51066534	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C=COC3=O)(C)CO)O	332.40	unknown	via CMAUP database
(3Z)-3-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]furan-2-one	44181907	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C=COC3=O)(C)CO)O	332.40	unknown	via CMAUP database
2(3H)-Furanone, 3-(2-((1S,4aS,5R,6R,8aS)-decahydro-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl)ethylidene)-, (3E)-	78577438	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C=COC3=O)(C)CO)O	332.40	unknown	via CMAUP database
3-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]furan-2-one	452936	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C=COC3=O)(C)CO)O	332.40	unknown	https://doi.org/10.1016/J.FITOTE.2010.03.003
3-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]furan-2-one	53394883	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C=COC3=O)(C)CO)O	332.40	unknown	https://doi.org/10.1021/JF903629J
4-[2-(1,3,6-trimethyl-8,9-dihydro-7H-benzo[7]annulen-2-yl)ethyl]-2H-furan-5-one	44206466	Click to see CC1=CC2=C(CCC1)C(=C(C(=C2)C)CCC3=CCOC3=O)C	296.40	unknown	https://doi.org/10.1016/J.TETLET.2009.05.097
Dehydroandrographolide	6473762	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C=COC3=O)(C)CO)O	332.40	unknown	https://doi.org/10.1021/JF903629J
> Organoheterocyclic compounds / Isoquinolines and derivatives / Benzylisoquinolines
4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]phenol	45358120	Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC)OC	624.80	unknown	via CMAUP database
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
(3E,4S)-3-[2-[(2aR,4aS,5R,8aS,8bR)-4a,8b-dimethyl-6-methylidene-1,2a,3,4,5,7,8,8a-octahydronaphtho[2,1-b]oxet-5-yl]ethylidene]-4-hydroxyoxolan-2-one	132217520	Click to see CC12CCC3C(C1CCC(=C)C2CC=C4C(COC4=O)O)(CO3)C	332.40	unknown	https://doi.org/10.1016/S0031-9422(00)90437-0
(3E)-3-[2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-hydroxyethylidene]oxolan-2-one	44575279	Click to see CC12CCC(C(C1CCC(=C)C2C(C=C3CCOC3=O)O)(C)CO)O	350.40	unknown	via CMAUP database
(3Z,4S)-3-[2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one	7067325	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050211N
(3Z,4S)-3-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,6,8a-trimethyl-2-methylidene-1,3,4,4a,7,8-hexahydronaphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one	163193646	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)(C)O	364.50	unknown	https://doi.org/10.1016/J.FITOTE.2010.03.003
(3Z)-3-[2-[(1R,4aR,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]oxolan-2-one	162908957	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3CCOC3=O)(C)CO)O	334.40	unknown	https://doi.org/10.1002/HLCA.200690237
(3Z)-3-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]oxolan-2-one	162669031	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3CCOC3=O)(C)CO)O	334.40	unknown	https://doi.org/10.1016/J.FITOTE.2010.03.003
(4S)-3-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,6,8a-trimethyl-2-methylidene-1,3,4,4a,7,8-hexahydronaphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one	162869835	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)(C)O	364.50	unknown	https://doi.org/10.1016/J.FITOTE.2010.03.003
[(3S,4E)-4-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-5-oxooxolan-3-yl] acetate	73353957	Click to see CC(=O)OC1COC(=O)C1=CCC2C(=C)CCC3C2(CCC(C3(C)CO)O)C	392.50	unknown	via CMAUP database
14-Epiandrographolide, >=95% (LC/MS-ELSD)	11869597	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1039/P19730001247 https://doi.org/10.1002/CHIN.201029197
3-[(Z)-2-[(1R,4abeta)-2-Methylene-5alpha-(hydroxymethyl)-5,8aalpha-dimethyl-6alpha-hydroxydecalin-1alpha-yl]ethylidene]-4-hydroxytetrahydrofuran-2-one	11078630	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1021/NP050211N https://doi.org/10.1016/S0031-9422(03)00051-7 https://doi.org/10.1002/PTR.2493 https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1080/10286020701273627 https://doi.org/10.1021/NP0704452
3-[2-(4a,8b-Dimethyl-6-methylidene-1,2a,3,4,5,7,8,8a-octahydronaphtho[2,1-b]oxet-5-yl)ethylidene]-4-hydroxyoxolan-2-one	163023093	Click to see CC12CCC3C(C1CCC(=C)C2CC=C4C(COC4=O)O)(CO3)C	332.40	unknown	https://doi.org/10.1016/S0031-9422(00)90437-0
3-[2-[(4aS,5R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one	129010368	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050211N
3-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]oxolan-2-one	363865	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3CCOC3=O)(C)CO)O	334.40	unknown	https://doi.org/10.1016/J.FITOTE.2010.03.003 https://doi.org/10.1002/HLCA.200690237
4-{2-[6-Hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidenedecahydronaphthalen-1-yl]ethylidene}-5-oxotetrahydrofuran-3-yl acetate	71589914	Click to see CC(=O)OC1COC(=O)C1=CCC2C(=C)CCC3C2(CCC(C3(C)CO)O)C	392.50	unknown	via CMAUP database
4-Hydroxy-3-[2-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-decalin-1-yl]ethylidene]tetrahydrofuran-2-one	343585	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1007/S11033-011-1341-X https://doi.org/10.1016/J.BCP.2009.12.014 https://doi.org/10.1002/CHIN.201029197 https://doi.org/10.1016/J.JPBA.2005.04.003 https://doi.org/10.1021/NP050211N https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2948634/ https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1080/10286020801948334 https://doi.org/10.1039/P19730001247 https://doi.org/10.1016/J.FITOTE.2010.03.003 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1021/NP050160U
Andrographolide	5318517	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050211N https://doi.org/10.1016/S0731-7085(99)00297-6 https://doi.org/10.1177/1534735406291984 https://doi.org/10.1002/PTR.2493 https://doi.org/10.1016/J.JEP.2004.03.004 https://doi.org/10.1016/S0378-8741(97)00099-8 https://doi.org/10.1021/NP050160U https://doi.org/10.1002/PTR.2650050408 https://doi.org/10.1002/(SICI)1099-1565(200001/02)11:1<34::AID-PCA487>3.0.CO;2-V https://doi.org/10.1016/S0944-7113(97)80002-5 https://doi.org/10.1080/14786410410001709197 https://doi.org/10.1248/BPB.25.1169 https://doi.org/10.1016/J.BCP.2009.12.014 https://doi.org/10.1016/S0021-9673(01)01160-8 https://doi.org/10.1021/NP0704452 https://doi.org/10.1016/S0031-9422(03)00051-7 https://doi.org/10.1007/S11418-006-0115-6 https://doi.org/10.1081/JLC-120004750 https://doi.org/10.1002/PCA.2800030308 https://doi.org/10.1039/P29900001011 https://doi.org/10.1021/NP50097A002 https://doi.org/10.1007/S11033-011-1341-X https://doi.org/10.1076/1388-0209(200007)3831-SFT204 https://doi.org/10.1080/10286020801948334 https://doi.org/10.1080/10286020701273627 https://doi.org/10.3109/13880209009082833 https://doi.org/10.1016/J.JPBA.2005.04.003 https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.3109/13880209209054010 https://doi.org/10.1248/CPB.32.2117 https://doi.org/10.1002/PCA.644 https://doi.org/10.1016/0006-2952(93)90364-3 https://doi.org/10.1076/PHBI.36.1.72.4620 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2948634/
Andropanolide	7067324	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1021/NP050160U https://doi.org/10.1016/J.FITOTE.2010.03.003 https://doi.org/10.1021/NP050211N https://doi.org/10.1248/CPB.42.1216 https://doi.org/10.1021/NP0704452
CID 23239822	23239822	Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)O	350.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
> Organoheterocyclic compounds / Oxepanes
(1aS,2aS,6aR)-1a-(hydroxymethyl)-5-(4-methylpent-3-enyl)-2a,6a-dihydro-2H-oxireno[2,3-f][1]benzofuran-4,6-dione	101289824	Click to see CC(=CCCC1=C2C(CC3(C(C2=O)O3)CO)OC1=O)C	278.30	unknown	https://doi.org/10.1039/C19680001493
(1aS,2aS,6S,6aS)-6-hydroxy-1a-(hydroxymethyl)-5-(4-methylpent-3-enyl)-2,2a,6,6a-tetrahydrooxireno[2,3-f][1]benzofuran-4-one	101289823	Click to see CC(=CCCC1=C2C(CC3(C(C2O)O3)CO)OC1=O)C	280.32	unknown	https://doi.org/10.1139/V84-355 https://doi.org/10.1039/C19680001493 https://doi.org/10.1039/C39830001189
1a-(hydroxymethyl)-5-(4-methylpent-3-enyl)-2a,6a-dihydro-2H-oxireno[2,3-f][1]benzofuran-4,6-dione	78385396	Click to see CC(=CCCC1=C2C(CC3(C(C2=O)O3)CO)OC1=O)C	278.30	unknown	https://doi.org/10.1039/C19680001493
6-Hydroxy-1a-(hydroxymethyl)-5-(4-methylpent-3-enyl)-2,2a,6,6a-tetrahydrooxireno[2,3-f][1]benzofuran-4-one	78385395	Click to see CC(=CCCC1=C2C(CC3(C(C2O)O3)CO)OC1=O)C	280.32	unknown	https://doi.org/10.1039/C19680001493
Paniculide A	11821485	Click to see CC(=CCCC1=C2C(CC3(C(C2O)O3)C)OC1=O)C	264.32	unknown	https://doi.org/10.1039/C19680001493 https://doi.org/10.1039/C39830001189
> Organoheterocyclic compounds / Pyridines and derivatives / Pyridinecarboxylic acids and derivatives / Pyridinecarboxamides / Nicotinamides
Nicotinamide	936	Click to see C1=CC(=CN=C1)C(=O)N	122.12	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	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoic acid	709	Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O	194.18	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
3,4-Dihydroxy cinnamic acid	2518	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
Caffeic Acid	689043	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
Ferulic acid	445858	Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O	194.18	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
Cianidanol	9064	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
> 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	via CMAUP database
(+)-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	via CMAUP database
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	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavones
2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-olate luteolin-7-olate(1-)	25201972	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)[O-]	285.23	unknown	via CMAUP database
Apigenin	5280443	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O	270.24	unknown	https://doi.org/10.1080/10286020701273627
Apigenin-7-olate	25200950	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)[O-])O	269.23	unknown	via CMAUP database
Isoscutellarein	5281665	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)O)O	286.24	unknown	via CMAUP database
Luteolin	5280445	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O	286.24	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
Hibiscetin	15559735	Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(O2)C(=C(C=C3O)O)O)O	334.23	unknown	via CMAUP database
Isorhamnetin	5281654	Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O	316.26	unknown	via CMAUP database
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	via CMAUP database
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	via CMAUP database
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/10.1080/10286020701273627
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides
Isoswertisin	44258317	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)O	446.40	unknown	https://doi.org/10.1080/10286020701273627
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-7-O-glucuronides
Oroxindin	3084961	Click to see COC1=C(C=C(C2=C1OC(=CC2=O)C3=CC=CC=C3)O)OC4C(C(C(C(O4)C(=O)O)O)O)O	460.40	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
2-(2,3-dimethoxyphenyl)-7,8-dimethoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	11972378	Click to see COC1=CC=CC(=C1OC)C2=CC(=O)C3=C(O2)C(=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)OC)OC	520.50	unknown	https://doi.org/10.1248/CPB.35.4429
2-(2,3-Dimethoxyphenyl)-7,8-dimethoxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	13963768	Click to see COC1=CC=CC(=C1OC)C2=CC(=O)C3=C(O2)C(=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)OC)OC	520.50	unknown	https://doi.org/10.1248/CPB.35.4429
2-(2,5-Dimethoxyphenyl)-7,8-dimethoxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	91989998	Click to see COC1=CC(=C(C=C1)OC)C2=CC(=O)C3=C(O2)C(=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)OC)OC	520.50	unknown	https://doi.org/10.1248/CPB.55.455
2-(4-hydroxy-2,3-dimethoxyphenyl)-7,8-dimethoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	5318512	Click to see COC1=C(C2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C=C(O2)C4=C(C(=C(C=C4)O)OC)OC)OC	536.50	unknown	https://doi.org/10.1248/CPB.35.4429
2-(4-hydroxy-2,3-dimethoxyphenyl)-7,8-dimethoxy-5-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	163007766	Click to see COC1=C(C2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C=C(O2)C4=C(C(=C(C=C4)O)OC)OC)OC	536.50	unknown	https://doi.org/10.1248/CPB.35.4429
4H-1-Benzopyran-4-one, 5-(beta-D-glucopyranosyloxy)-7-hydroxy-8-methoxy-2-phenyl-	5488686	Click to see COC1=C2C(=C(C=C1O)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C=C(O2)C4=CC=CC=C4	446.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5-hydroxy-2-[2-hydroxy-3-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7,8-dimethoxychromen-4-one	21550410	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=C(C(=CC=C3)OC4C(C(C(C(O4)CO)O)O)O)O)OC	492.40	unknown	https://doi.org/10.1248/CPB.35.4429
5-Hydroxy-2-[2-hydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7,8-dimethoxychromen-4-one	13963763	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=C(C(=CC=C3)OC4C(C(C(C(O4)CO)O)O)O)O)OC	492.40	unknown	https://doi.org/10.1248/CPB.35.4429
5-Hydroxy-7,8-dimethoxy (2R)-flavanone-5-o-beta-D-glucopyranoside	16215025	Click to see COC1=C(C2=C(C(=O)CC(O2)C3=CC=CC=C3)C(=C1)OC4C(C(C(C(O4)CO)O)O)O)OC	462.40	unknown	https://doi.org/10.1248/CPB.55.455
5-Hydroxy-7,8,2',5'-tetramethoxy-flavone-5-o-beta-D-glucopyranoside	16215023	Click to see COC1=CC(=C(C=C1)OC)C2=CC(=O)C3=C(O2)C(=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)OC)OC	520.50	unknown	https://doi.org/10.1248/CPB.55.455
5,4'-Dihidroxy-7,8,2',3'-tetramethoxy flavone 5-glucoside	13963764	Click to see COC1=C(C2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C=C(O2)C4=C(C(=C(C=C4)O)OC)OC)OC	536.50	unknown	https://doi.org/10.1248/CPB.35.4429
7,8-dimethoxy-2-(2-methoxyphenyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	5318498	Click to see COC1=CC=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)OC)OC	490.50	unknown	https://doi.org/10.1248/CPB.35.4429
7,8-Dimethoxy-2-(2-methoxyphenyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one	13963769	Click to see COC1=CC=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)OC)OC	490.50	unknown	https://doi.org/10.1248/CPB.35.4429
7,8-dimethoxy-2-phenyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one	5318465	Click to see COC1=C(C2=C(C(=O)CC(O2)C3=CC=CC=C3)C(=C1)OC4C(C(C(C(O4)CO)O)O)O)OC	462.40	unknown	via CMAUP database
7,8-Dimethoxy-2-phenyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one	13963761	Click to see COC1=C(C2=C(C(=O)CC(O2)C3=CC=CC=C3)C(=C1)OC4C(C(C(C(O4)CO)O)O)O)OC	462.40	unknown	https://doi.org/10.1248/CPB.35.4429 https://doi.org/10.1248/CPB.55.455
7,8-Dimethoxy-2-phenyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	13963766	Click to see COC1=C(C2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C=C(O2)C4=CC=CC=C4)OC	460.40	unknown	https://doi.org/10.1248/CPB.35.4429 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
Andrographidin A	13963762	Click to see COC1=C(C2=C(C(=O)CC(O2)C3=CC=CC=C3)C(=C1)OC4C(C(C(C(O4)CO)O)O)O)OC	462.40	unknown	https://doi.org/10.1248/CPB.35.4429 https://doi.org/10.1248/CPB.55.455
Andrographidin B	11968627	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=C(C(=CC=C3)OC4C(C(C(C(O4)CO)O)O)O)O)OC	492.40	unknown	https://doi.org/10.1248/CPB.35.4429
Andrographidine C	5318484	Click to see COC1=C(C2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C=C(O2)C4=CC=CC=C4)OC	460.40	unknown	https://doi.org/10.1248/CPB.35.4429 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
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
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	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
Apigetrin	5280704	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O	432.40	unknown	https://doi.org/10.1080/10286020701273627
> Phenylpropanoids and polyketides / Flavonoids / Hydroxyflavonoids / 7-hydroxyflavonoids
Cyanidin	128861	Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2O)O)O)O)O	287.24	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 3-O-methylated flavonoids
Peonidin	441773	Click to see COC1=C(C=CC(=C1)C2=[O+]C3=CC(=CC(=C3C=C2O)O)O)O	301.27	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids
5-Hydroxy-3',4',7-trimethoxyflavone	5272653	Click to see COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC)O)OC	328.30	unknown	https://doi.org/10.1016/S0031-9422(03)00051-7
5-Hydroxy-7,2',3'-trimethoxyflavone	12135219	Click to see COC1=CC=CC(=C1OC)C2=CC(=O)C3=C(C=C(C=C3O2)OC)O	328.30	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5-Hydroxy-7,2',6'-trimethoxyflavone	5318369	Click to see COC1=C(C(=CC=C1)OC)C2=CC(=O)C3=C(C=C(C=C3O2)OC)O	328.30	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1016/S0031-9422(03)00051-7
5,7,2',3'-Tetramethoxyflavanone	12135218	Click to see COC1=CC=CC(=C1OC)C2CC(=O)C3=C(O2)C=C(C=C3OC)OC	344.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5,7,2',3'-Tetramethoxyflavanone	21579286	Click to see COC1=CC=CC(=C1OC)C2CC(=O)C3=C(O2)C=C(C=C3OC)OC	344.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
Apigenin 7,4'-dimethyl ether	5281601	Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC)O	298.29	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 8-O-methylated flavonoids
(S)-5-Hydroxy-7,8-dimethoxy-2-phenylchroman-4-one	13963771	Click to see COC1=C(C2=C(C(=O)CC(O2)C3=CC=CC=C3)C(=C1)O)OC	300.30	unknown	https://doi.org/10.1021/JF903629J https://doi.org/10.1016/S0031-9422(00)80122-3 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5-Hydroxy-2-(2-hydroxyphenyl)-7,8-dimethoxy-2,3-dihydrochromen-4-one	85434272	Click to see COC1=C(C2=C(C(=O)CC(O2)C3=CC=CC=C3O)C(=C1)O)OC	316.30	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5-Hydroxy-2',3',7,8-tetramethoxyflavone	5319878	Click to see COC1=CC=CC(=C1OC)C2=CC(=O)C3=C(O2)C(=C(C=C3O)OC)OC	358.30	unknown	https://doi.org/10.1248/CPB.35.4429 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5-Hydroxy-3,7,8,2'-tetramethoxyflavone	14887327	Click to see COC1=CC=CC=C1C2=C(C(=O)C3=C(O2)C(=C(C=C3O)OC)OC)OC	358.30	unknown	https://doi.org/10.1016/S0031-9422(00)80122-3
5-hydroxy-7,8-dimethoxy-2-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one	100984956	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=CC=CC=C3OC4C(C(C(C(O4)CO)O)O)O)OC	476.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5-Hydroxy-7,8-dimethoxy-2-[2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one	74977899	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=CC=CC=C3OC4C(C(C(C(O4)CO)O)O)O)OC	476.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5-Hydroxy-7,8-dimethoxyflavanone	13963770	Click to see COC1=C(C2=C(C(=O)CC(O2)C3=CC=CC=C3)C(=C1)O)OC	300.30	unknown	https://doi.org/10.1021/JF903629J https://doi.org/10.1016/S0031-9422(00)80122-3 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5-Hydroxy-7,8-dimethoxyflavone	188316	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=CC=CC=C3)OC	298.29	unknown	https://doi.org/10.1016/S0031-9422(00)80122-3 https://doi.org/10.1248/CPB.35.4429 https://doi.org/10.1021/JF903629J https://doi.org/10.1080/10286020701273627 https://doi.org/10.1016/S0031-9422(03)00051-7 https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5-Hydroxy-7,8,2',5'tetramethoxyflavone	10948318	Click to see COC1=CC(=C(C=C1)OC)C2=CC(=O)C3=C(O2)C(=C(C=C3O)OC)OC	358.30	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5,2'-Dihydroxy-7,8-dimethoxyflavanone	12098358	Click to see COC1=C(C2=C(C(=O)CC(O2)C3=CC=CC=C3O)C(=C1)O)OC	316.30	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008
5,4'-Dihidroxy-7,8,2',3'-tetramethoxyflavone	13963777	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=C(C(=C(C=C3)O)OC)OC)OC	374.30	unknown	https://doi.org/10.1248/CPB.35.4429
Andrographin	5318506	Click to see COC1=CC=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)OC)OC	328.30	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1016/S0031-9422(03)00051-7
Skullcapflavone I	5320399	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=CC=CC=C3O)OC	314.29	unknown	https://doi.org/10.1080/10286020701273627
Wogonin	5281703	Click to see COC1=C(C=C(C2=C1OC(=CC2=O)C3=CC=CC=C3)O)O	284.26	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Pyranoflavonoids
5,7-Dihydroxy-2-(5-hydroxy-2,2-dimethylchromen-6-yl)chromen-4-one	46844473	Click to see CC1(C=CC2=C(O1)C=CC(=C2O)C3=CC(=O)C4=C(C=C(C=C4O3)O)O)C	352.30	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.05.008 https://doi.org/10.1016/S0031-9422(03)00051-7
> Phenylpropanoids and polyketides / Isoflavonoids / Isoflavans / Isoflavanols
(2S,3R,4S,5S,6R)-2-[[3-(6-hydroxy-4,5-dimethoxycyclohex-2-en-1-yl)-3,4-dihydro-2H-chromen-7-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	11972371	Click to see COC1C=CC(C(C1OC)O)C2CC3=C(C=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)OC2	468.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Isoflavonoids / Isoflavonoid C-glycosides
5,7-dihydroxy-3-(4-hydroxyphenyl)-8-[(2S,3R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-6-[(2S,4R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one	44257269	Click to see C1=CC(=CC=C1C2=COC3=C(C(=C(C(=C3C2=O)O)C4C(C(C(C(O4)CO)O)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O	594.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Isoflavonoids / O-methylated isoflavonoids / 4-O-methylated isoflavonoids
Vestitol, (-)-	182259	Click to see COC1=CC(=C(C=C1)C2CC3=C(C=C(C=C3)O)OC2)O	272.29	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Phenylpropanoic acids
Eucomic acid, (-)-	23757219	Click to see C1=CC(=CC=C1CC(CC(=O)O)(C(=O)O)O)O	240.21	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Tannins
1,2,4,6-Tetragalloylglucose	11297287	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O	788.60	unknown	via CMAUP database
1,6-bis-O-galloyl-beta-D-glucose	440221	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O	484.40	unknown	via CMAUP database
beta-Glucogallin	124021	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OC2C(C(C(C(O2)CO)O)O)O	332.26	unknown	via CMAUP database
NP-003686	73178	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)O	788.60	unknown	via CMAUP database
Pentagalloylglucose	65238	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O	940.70	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins
(10R,11R,13R,14R,15S)-3,4,5,11,14,20,21,22-octahydroxy-13-(hydroxymethyl)-9,12,16-trioxatetracyclo[16.4.0.02,7.010,15]docosa-1(22),2,4,6,18,20-hexaene-8,17-dione	11754973	Click to see C1=C2C(=C(C(=C1O)O)O)C3=C(C(=C(C=C3C(=O)OC4C(C(C(OC4O)CO)O)OC2=O)O)O)O	482.30	unknown	via CMAUP database
[(10R,11R,13R,14R,15S)-3,4,5,11,20,21,22-heptahydroxy-8,17-dioxo-14-(3,4,5-trihydroxybenzoyl)oxy-9,12,16-trioxatetracyclo[16.4.0.02,7.010,15]docosa-1(22),2,4,6,18,20-hexaen-13-yl]methyl 3,4,5-trihydroxybenzoate	14284542	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C3C(C(O2)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O3)O)O)O)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O	786.60	unknown	via CMAUP database
[(10R,11S,13R,14R,15S)-3,4,5,14,20,21,22-heptahydroxy-8,17-dioxo-11-(3,4,5-trihydroxybenzoyl)oxy-9,12,16-trioxatetracyclo[16.4.0.02,7.010,15]docosa-1(22),2,4,6,18,20-hexaen-13-yl]methyl 3,4,5-trihydroxybenzoate	14429414	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C3C(C(O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O3)O)O)O)O)O)O)O	786.60	unknown	via CMAUP database
[(1S,19R,21S,22R,23R)-6,7,8,11,12,13,23-heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyl)oxy-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4,6,8,10,12,14-hexaen-22-yl] 3,4,5-trihydroxybenzoate	14284664	Click to see C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O1)O)O)O)O)O)O)O	786.60	unknown	via CMAUP database
2-[[(1R,7R,8S,26R,28S,29R,38R)-1,14,15,18,19,20,34,35,39,39-decahydroxy-2,5,10,23,31-pentaoxo-28-(3,4,5-trihydroxybenzoyl)oxy-6,9,24,27,30,40-hexaoxaoctacyclo[34.3.1.04,38.07,26.08,29.011,16.017,22.032,37]tetraconta-3,11,13,15,17,19,21,32,34,36-decaen-13-yl]oxy]-3,4,5-trihydroxybenzoic acid	16201525	Click to see C1C2C3C(C(C(O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C6=C5C7C(=CC(=O)C(C7(O)O)(O6)O)C(=O)O3)O)O)OC(=O)C8=CC(=C(C(=C8C9=C(C(=C(C=C9C(=O)O1)O)O)O)O)O)OC1=C(C(=C(C=C1C(=O)O)O)O)O	1120.70	unknown	via CMAUP database
2-[[(1S,19R,21S,22R,23R)-6,7,8,11,12,22,23-heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyl)oxy-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4,6,8,10,12,14-hexaen-13-yl]oxy]-3,4,5-trihydroxybenzoic acid	46905124	Click to see C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O1)OC6=C(C(=C(C=C6C(=O)O)O)O)O)O)O)O)O)O)O	802.60	unknown	via CMAUP database
3,3a(2),4a(2)-Tri-O-methylellagic acid	11674590	Click to see COC1=C(C2=C3C(=C1)C(=O)OC4=C3C(=CC(=C4OC)OC)C(=O)O2)O	344.30	unknown	via CMAUP database
4,4'-Di-O-methylellagic acid	11580745	Click to see COC1=C(C2=C3C(=C1)C(=O)OC4=C3C(=CC(=C4O)OC)C(=O)O2)O	330.24	unknown	via CMAUP database
Casuarictin	73644	Click to see C1C2C(C3C(C(O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O3)O)O)O)O)O)O)OC(=O)C7=CC(=C(C(=C7C8=C(C(=C(C=C8C(=O)O1)O)O)O)O)O)O	936.60	unknown	via CMAUP database
Corilagin	73568	Click to see C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O1)O)O)O)O)O)O)O	634.50	unknown	via CMAUP database
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
Geraniin	3001497	Click to see C1C2C3C(C(C(O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C6=C5C7C(=CC(=O)C(C7(O)O)(O6)O)C(=O)O3)O)O)OC(=O)C8=CC(=C(C(=C8C9=C(C(=C(C=C9C(=O)O1)O)O)O)O)O)O	952.60	unknown	via CMAUP database
Giadmmrdajabjm-oaqcrpkasa-	21668995	Click to see C1C(C2C(O1)(C3(C(=O)O2)C45CC(=O)C(O3)(C6(C4C7=C(O6)C(=C(C=C7C(=O)OC8C(C(C(OC8OC(=O)C9=CC(=C(C(=C9)O)O)O)CO)OC5=O)O)O)O)O)O)O)O	808.60	unknown	via CMAUP database
Mahtabin A	10557787	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C3C(C(O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O3)O)O)O)O)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O	938.70	unknown	via CMAUP database
Mallotinic Acid	10056140	Click to see C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O1)O)O)O)O)O)OC6=C(C(=C(C=C6C(=O)O)O)O)O)O	802.60	unknown	via CMAUP database
Mallotusinin	514180	Click to see C1C2C3C(C(C(O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C6=C5C7=C(O6)C(=C(C=C7C(=O)O3)O)O)O)O)OC(=O)C8=CC(=C(C(=C8C9=C(C(=C(C=C9C(=O)O1)O)O)O)O)O)O	918.60	unknown	via CMAUP database
Pmgvhtaltibnie-gloqphdasa-	21668994	Click to see C1C(C2C(O1)(C3(C(=O)O2)C45CC(=O)C(O3)(C6(C4C7=C(O6)C(=C(C=C7C(=O)OC8C9C(C(COC(=O)C1=CC(=C(C(=C1C1=C(C(=C(C=C1C(=O)O9)OC1=C(C(=C(C=C1C(=O)O)O)O)O)O)O)O)O)O)OC8OC(=O)C1=CC(=C(C(=C1)O)O)O)OC5=O)O)O)O)O)O)O	1278.90	unknown	via CMAUP database
Punicafolin	5320800	Click to see C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O1)O)O)O)O)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O	938.70	unknown	via CMAUP database
Xcxwmhrrisfuff-xngpzlstsa-	21636130	Click to see C1C(C2C(O1)(C3(C(=O)O2)C45CC(=O)C(O3)(C6(C4C7=C(O6)C(=C(C=C7C(=O)OC8C9C(C(COC(=O)C1=CC(=C(C(=C1C1=C(C(=C(C=C1C(=O)O9)O)O)O)O)O)O)OC8OC(=O)C1=CC(=C(C(=C1)O)O)O)OC5=O)O)O)O)O)O)O	1110.80	unknown	via CMAUP database

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Andrographis paniculata

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