Exact Mass: 328.1077
Exact Mass Matches: 328.1077
Found 500 metabolites which its exact mass value is equals to given mass value 328.1077,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
7-Hydroxy-6-methyl-8-ribityl lumazine
7-Hydroxy-6-methyl-8-ribityl lumazine is an intermediate in Riboflavin metabolism. it is converted from 6,7-Dimethyl-8-(1-D-ribityl)lumazine. [HMDB] 7-Hydroxy-6-methyl-8-ribityl lumazine is an intermediate in Riboflavin metabolism. it is converted from 6,7-Dimethyl-8-(1-D-ribityl)lumazine.
Anisatin
ANIASATIN, also known as shikimin, is a member of the class of compounds known as terpene lactones. Terpene lactones are prenol lipids containing a lactone ring. ANIASATIN is soluble (in water) and a very weakly acidic compound (based on its pKa). Anisatin, a pure toxic substance isolated from the seeds of a Japanese plant (Illicium anisatum) acts as a picrotoxin-like, non-competitive GABA antagonist. Anisatin suppresses GABA-induced currents in a concentration-dependent manner with an EC50 of ~1.10?μM[1]. Anisatin, a pure toxic substance isolated from the seeds of a Japanese plant (Illicium anisatum) acts as a picrotoxin-like, non-competitive GABA antagonist. Anisatin suppresses GABA-induced currents in a concentration-dependent manner with an EC50 of ~1.10?μM[1].
Dihydromelilotoside
Dihydromelilotoside is found in herbs and spices. Dihydromelilotoside is isolated from Chinese cinnamon. Isolated from Chinese cinnamon. Dihydromelilotoside is found in herbs and spices.
Ethylvanillin glucoside
Ethylvanillin glucoside is a flavouring ingredient with vanilla aroma. Flavouring ingredient with vanilla aroma
3,4-Dichloro-n-{[1-(dimethylamino)cyclohexyl]methyl}benzamide
Girisopam
C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
n-(3,4-Dichlorophenyl)-n-[(1r,2s)-2-(dimethylamino)cyclopentyl]propanamide
Tubulin Polymerization Inhibitor
(3-(Tert-Butoxyimino-methyl)-4-chloro-phenyl)-thiocarbamic acid, O-isopropyl ester
Androsin
Androsin is a natural product found in Justicia adhatoda, Penstemon pinifolius, and other organisms with data available. Androsin is an active compound isolated from Picrorhiza Kurroa Royle ex Benth, with anti-asthmatic effects[1]. Androsin is an active compound isolated from Picrorhiza Kurroa Royle ex Benth, with anti-asthmatic effects[1].
3-Hydroxy-5,7,4-trimethoxyflavone
3-Hydroxy-5,7,4′-trimethoxyflavone is a flavonol can be isolated from Cucubalus baccifer (L.)[1].
hyperxanthone E
A pyranoxanthene that is 2,3-dihydropyrano[3,2-a]xanthen-12(1H)-one substituted by hydroxy groups at positions 5, 9 and 11 and geminal methyl groups at position 3. Isolated from the aerial parts of Hypericum scabrum, it exhibits cytotoxicity for human tumour cells.
Luteolin 7,3,4-trimethyl ether
7,3',4'-Tri-O-methylluteolin (5-Hydroxy-3',4',7-trimethoxyflavone), a flavonoid compound, possesses potent anti-inflammatory effects in LPS-induced macrophage cell line mediated by inhibition of release of inflammatory mediators, NO, PGE2, and pro-inflammatory cytokines. 7,3',4'-Tri-O-methylluteolin significantly induces reduction in the mRNA expressions of inducible nitric oxide synthase and cyclooxygenase-2[1]. 7,3',4'-Tri-O-methylluteolin (5-Hydroxy-3',4',7-trimethoxyflavone), a flavonoid compound, possesses potent anti-inflammatory effects in LPS-induced macrophage cell line mediated by inhibition of release of inflammatory mediators, NO, PGE2, and pro-inflammatory cytokines. 7,3',4'-Tri-O-methylluteolin significantly induces reduction in the mRNA expressions of inducible nitric oxide synthase and cyclooxygenase-2[1].
3,7,4-Tri-O-methylkaempferol
Kaempferol 3,7,4'-trimethyl ether is a flavonol aglycone isolated from the leaves of Siparuna gigantotepala, has antioxidant activity[1]. Kaempferol 3,7,4'-trimethyl ether is a flavonol aglycone isolated from the leaves of Siparuna gigantotepala, has antioxidant activity[1].
5-Hydroxy-7,2,5-trimethoxyflavone
5-Hydroxy-7,2,6-trimethoxyflavone
6,8-Di-C-methylluteolin 7-methyl ether
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-methoxy-6,8-dimethyl-4H-1-benzopyran-4-one
3-(4-methoxybenzylidene)-5,7-dihydroxy-6-methoxychroman-4-one
3-Formyl-2,6,beta-trihydroxy-4-methoxy-5-methylchalcone
Salvigenin
Salvigenin is a natural polyphenolic compound, with neuroprotective effect. Salvigenin has antitumor cytotoxic and immunomodulatory properties. Salvigenin inhibits H2O2-induced cell apoptosis[1][2]. Salvigenin is a natural polyphenolic compound, with neuroprotective effect. Salvigenin has antitumor cytotoxic and immunomodulatory properties. Salvigenin inhibits H2O2-induced cell apoptosis[1][2].
6-Hydroxy-5,7,4-trimethoxyflavone
Isoscutellarein 7,8,4-trimethyl ether
2-Amino-4-(4-chlorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
O2-(4-Methoxybenzoyl)-2,3-dihydro-1,4-benzodioxine-2-carbohydroximamide
3-HYDROXY-3,4,5-TRIMETHOXYFLAVONE
relative retention time with respect to 9-anthracene Carboxylic Acid is 1.258 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.259 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.257
1-(4-hydroxyphenyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-1-one
1-[2-hydroxy-6-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]ethanone
1-[4-hydroxy-2-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]ethanone
Scleroderolide
CONFIDENCE isolated standard
5,9,10-trihydroxy-1,2,2-trimethyl-1,2-dihydro-6h-furo[2,3-c]xanthen-6-one
1??,2??-Epoxy-10??-hydroperoxy-3??,4??,8??-trihydroxyguaia-11(13)-en-12,6??-olide
4-(1,1-Dimethyl-2-propenyl)-1,3,5,8-tetrahydroxy-9H-xanthene-9-one
1,3,7-trihydroxy-2-(2-hydroxy-3-methyl-3-butenyl)-xanthone
(2R)-2-(4-O-beta-D-glucopyranosylphenyl)propionic acid
(R)-3,5-dihydroxy-4,7-dimethoxyspiro[2H-1-benzopyran-3(4H),7-bicyclo[4.2.0]-octa[1,3,5]-trien]-4-one
(2R)-3-hydroxy-2-phenylpropionyl beta-D-glucopyranoside
5,7-Dihydroxy 3,4-dimethoxyspiro[chroman-3,7-bicyclo[4.2.0]octa-[1(6),2,4]triene]-4-one
(3R)-4,6-dimethoxy-3-[4-oxo-6-{(1E)-prop-1-en-1-yl}-4-H-pyran-3-yl]-2-benzofuran-1(3H)one|Fijiensin|Vermistatin
4-Me ether-Punctatin+|4-O-Methyl-punctatin|5,7-Dihydroxy-8-methoxy-3-(4-methoxybenzyliden)-chroman-4-on
(2S)-2-hydroxyneomajucin|(2S)-hydroxyneomajucin|(2S*)-hydroxyneomajucin
1-O-ethyl-6-(p-hydroxybenzoyl)-beta-D-glucopyranoside|Ethyl (6-O-p-hydroxybenzoyl)-??-D-glucopyranoside
(2S)-3-O-beta-D-glucopyranosyl-2-phenylpropionic acid
(E)-caffeyl alcohol 4-O-beta-glucopyranoside|BJ-83|coniferin|Demethyl coniferin
5-Me ether,1-Et ether-1,3,5-Trihydroxy-2-hydroxymethylanthraquinone
(S)-8-formyl-3,5-dihydroxy-7-methoxy-6-methylflavanone
Diplotrin C
A monohydroxyflavone that is flavone substituted by a hydroxy group at position 2 and methoxy groups at positions 7, 4 and 5. It has been isolated from the aerial parts of Mimosa diplotricha.
1-Hydroxy-2,3,4-trimethoxy-7-methylanthracene-9,10-dione
6-hydroxy-2,7,8-trimethoxy-9,10-dihydro-5H-phenanthro[4,5-bcd]pyran-5-one|ochracinone
7-Hydroxy-3-(2-hydroxyphenyl)-5,6-dimethoxy-8-methyl-4H-1-benzopyran-4-one
6-Hydroxy-3-(2-hydroxyphenyl)-5,7-dimethoxy-8-methyl-4H-1-benzopyran-4-one
1-(3,5-dihydroxy-2-methylphenyl)ethanone-5-O-beta-D-glucopyranoside|monspelioside
1-(3,5-dihydroxyphenyl)propan-2-one 3-O-beta-glucopyranoside|grammatophylloside D
1-(2-hydroxy-6-methylphenyl)-2-hydroxyethanone 2-O-beta-D-glucopyranoside|juniperoside V
2-[2-(3-Hydroxy-4-methoxyphenyl)ethyl]-6,8-dihydroxychromone
1,3-dihydroxy-6-(2-hydroxypropyl)-8-methoxyanthracene-9,10-dione
(7Z)-9-nor-3,4,4-trihydroxy-3-methoxylign-7-ene-9,7-lactone|tectonoelin A
Kaempferol 3,7,4-trimethyl ether
Kaempferol 3,7,4'-trimethyl ether is a flavonol aglycone isolated from the leaves of Siparuna gigantotepala, has antioxidant activity[1]. Kaempferol 3,7,4'-trimethyl ether is a flavonol aglycone isolated from the leaves of Siparuna gigantotepala, has antioxidant activity[1].
1,5,6-Trimethoxy-2-methyl-3-hydroxy-9,10-anthraquinone
4,5-dihydro-1,6,7-trihydroxy-4,4,5-trimethylfurano(2,3:3,4)xanthone
2,3,4-trimethoxy-phenazine-1-carboxylic acid methyl ester|2.3.4-Trimethoxyphenazin-1-carbonsaeuremethylester
5-hydroxy-7-methoxy-6-methyl-3-(3,4-dihydroxybenzyl)chromone|7-Me ether-3-(3,4-Dihydroxybenzl)-5,7-dihydroxy-6-methylchromone
(2S)-2-(4-hydroxyphenyl)propionyl beta-D-glucopyranoside
dihydrocinnacasside|o-hydroxyphenylpropanoyl O-beta-D-glucopyranoside
2,4-bis(4-hydroxyphenyl)cyclobutane-1,3-dicarboxylic Acid
8-hydroxy-1,2,3-trimethoxy-6-methylanthracene-9,10-dione
2-(1-propen-1-yl)-4-hydroxymethyl-3-furanylcarbonyl alpha-L-rhamnopyranoside
2-hydroxy-1,3,7-trimethoxy-6-methy1-9,10-anthraquinone|6-hydroxy-3,5,7-trimethoxy-2-methy1-9,10-anthraquinone|chionone
1-(1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-1 ,3-propanedione
2,8-dimethoxy-6-methyl-9-oxo-9h-xanthene-1-carboxylic acid methyl ester
2-(2-Methoxy-4-hydroxyphenyl)-5,6-dimethoxybenzofuran-3-carbaldehyde
(Z)-8-[(4-acetoxy-3-methyl-2-butenyl)oxy]psoralen|(Z)-trichoclin acetate
4,7-Dihydroxy-2,3-dihydro-2-(1-hydroxy-1-methylethyl)-5H-furo[3,2-b]xanthene-5-one
4-Me ether,2-O-beta-D-glucopyranoside-2,4-Dihydroxyacetophenone,
2,7-Di Me,4,5-methylene ether-2,4,5,7-Tetrahydroxyflavanone|7,2-Dimethoxy-4,5-methylenedioxy-flavone
(1R,5R,6S,7R,8S,11S)-6,7,8-Triacetoxy-2,10-dioxatricyclo<6.2.1.05,11>undecan|(1R,5R,6S,7R,8S,11S)-6,7,8-Triacetoxy-2,10-dioxatricyclo[6.2.1.05,11]undecan
Biliatresone
Biliatresone is a member of the class of benzodioxoles that is 1,3-benzodioxole which is substituted at positions 5 by a 2-(2-hydroxyphenyl)-3-oxoprop-1-en-3-yl group and at positions 4 and 6 by methoxy groups. A very rare type of isoflavonoid-related 1,2-diaryl-2-propenone found in Dysphania glomulifera (red crumbweed) and D. littoralis, the enone moiety is particularly reactive, undergoing ready Michael addition of water and methanol. Biliatresone has been found to cause extrahepatic biliary atresia (obliteration or discontinuity of the extrahepatic biliary system, resulting in obstruction to bile flow) in a zebrafish model. It has a role as a toxin and a plant metabolite. It is a member of benzodioxoles, an enone, an aromatic ketone, an aromatic ether and a member of phenols. A member of the class of benzodioxoles that is 1,3-benzodioxole which is substituted at positions 5 by a 2-(2-hydroxyphenyl)-3-oxoprop-1-en-3-yl group and at positions 4 and 6 by methoxy groups. A very rare type of isoflavonoid-related 1,2-diaryl-2-propenone found in Dysphania glomulifera (red crumbweed) and D. littoralis, the enone moiety is particularly reactive, undergoing ready Michael addition of water and methanol. Biliatresone has been found to cause extrahepatic biliary atresia (obliteration or discontinuity of the extrahepatic biliary system, resulting in obstruction to bile flow) in a zebrafish model.
1,5,15-Trimethylmorindol
1,5,15-Tri-O-methylmorindol is a natural product found in Morinda citrifolia with data available.
ACon1_000906
Kaempferol 3,7,4-trimethyl ether is a natural product found in Aeonium lindleyi, Helichrysum cephaloideum, and other organisms with data available. Kaempferol 3,7,4'-trimethyl ether is a flavonol aglycone isolated from the leaves of Siparuna gigantotepala, has antioxidant activity[1]. Kaempferol 3,7,4'-trimethyl ether is a flavonol aglycone isolated from the leaves of Siparuna gigantotepala, has antioxidant activity[1].
Gonzalitosin I
5-Hydroxy-3,4,7-trimethoxyflavone is a natural product found in Lantana montevidensis, Leucas cephalotes, and other organisms with data available. 7,3',4'-Tri-O-methylluteolin (5-Hydroxy-3',4',7-trimethoxyflavone), a flavonoid compound, possesses potent anti-inflammatory effects in LPS-induced macrophage cell line mediated by inhibition of release of inflammatory mediators, NO, PGE2, and pro-inflammatory cytokines. 7,3',4'-Tri-O-methylluteolin significantly induces reduction in the mRNA expressions of inducible nitric oxide synthase and cyclooxygenase-2[1]. 7,3',4'-Tri-O-methylluteolin (5-Hydroxy-3',4',7-trimethoxyflavone), a flavonoid compound, possesses potent anti-inflammatory effects in LPS-induced macrophage cell line mediated by inhibition of release of inflammatory mediators, NO, PGE2, and pro-inflammatory cytokines. 7,3',4'-Tri-O-methylluteolin significantly induces reduction in the mRNA expressions of inducible nitric oxide synthase and cyclooxygenase-2[1].
Anisatin
A sesquiterpene lactone with formula C15H20O8. It is a neurotoxic natural product found in plants of the family Illiciaceae. Anisatin is a natural product found in Illicium henryi, Illicium simonsii, and other organisms with data available. Anisatin is a plant toxin found in the Japanese star anise (Illicium anisatum). The Japanese star anise has been burned as incense in Japan, where it is known as shikimi, as well as used in topical folk remedies. (L1226) Anisatin, a pure toxic substance isolated from the seeds of a Japanese plant (Illicium anisatum) acts as a picrotoxin-like, non-competitive GABA antagonist. Anisatin suppresses GABA-induced currents in a concentration-dependent manner with an EC50 of ~1.10?μM[1]. Anisatin, a pure toxic substance isolated from the seeds of a Japanese plant (Illicium anisatum) acts as a picrotoxin-like, non-competitive GABA antagonist. Anisatin suppresses GABA-induced currents in a concentration-dependent manner with an EC50 of ~1.10?μM[1].
6-Methyl-5,7a,13,13b-tetraaza-pentaphene-8,14-dione
Kaempferol-3,4,7-trimethyl ether
Kaempferol 3,7,4'-trimethyl ether is a flavonol aglycone isolated from the leaves of Siparuna gigantotepala, has antioxidant activity[1]. Kaempferol 3,7,4'-trimethyl ether is a flavonol aglycone isolated from the leaves of Siparuna gigantotepala, has antioxidant activity[1].
Paeonoside
Paeonoside is a glycoside. Paeonoside is a natural product found in Spiranthes sinensis, Spiranthes vernalis, and other organisms with data available.
C15H20O8_4-Acetyl-3-hydroxy-5-methylphenyl beta-D-glucopyranoside
C15H20O8_3-(4-Hydroxyphenyl)-3-oxopropyl beta-D-glucopyranoside
C15H20O8_2-Acetyl-5-hydroxy-3-methylphenyl beta-D-glucopyranoside
Dihydrocoumaroyl Hexoside
Annotation level-3
1-(4-hydroxyphenyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-1-one_major
5-hydroxy-3,7-dimethoxy-2-(4-methoxyphenyl)-4H-chromen-4-one
Americanin
Isoamericanin A
Americanin D
3-(4-Hydroxyphenyl)-3-oxopropyl ?-D-glucopyranoside
Sulfapyrazole
C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
1-(4-Amino-2-methylbenzoyl)-7-chloro-1,2,3,4-tetrahydro-5H-1-benzazepin-5-one
ethyl 2-[2-(tert-butoxycarbonylamino)thiazol-4-yl]-4-oxo-butanoat e
3-[AMINO(2-CHLOROPHENYL)METHYL]-2-INDOLECARBOXYLIC ACID ETHYL ESTER
9-Benxyloxy-3-(2-Chloro ethyl)-2-methyl pyrido[1,2-a]pyrimidine-4-one
6-Methyl-2-pyridinyl 2-(acetylamino)-2-deoxy-1-thio-beta-D-glucopyranoside
(2S,11bR)-10-chloro-2-methyl-11b-phenyl-2,3,5,7-tetrahydro-[1,3]oxazolo[3,2-d][1,4]benzodiazepin-6-one
[(2S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl benzoate
2,6-BIS-(4-METHOXY-PHENYL)-TETRAHYDRO-THIOPYRAN-4-ONE
5-Chloro-1-(4-fluorophenyl)-3-(piperidin-4-yl)-1H-indole
2-[2-(2-Mercaptoethoxy)ethoxy]ethyl alpha-D-galactopyranoside
2-ETHOXY-5-[(4-METHYLPIPERAZIN-1-YL)SULFONYL]BENZOIC ACID
N-(5-Aminopentyl)-1-naphthalenesulfonamide Hydrochloride
Oxazolam
C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
(3-(Tert-Butoxyimino-methyl)-4-chloro-phenyl)-thiocarbamic acid, O-isopropyl ester
(4r)-7-Chloro-9-Methyl-1-Oxo-1,2,4,9-Tetrahydrospiro[beta-Carboline-3,4-Piperidine]-4-Carbonitrile
2-[3-[(4-ethoxycarbonylphenyl)hydrazinylidene]-6-oxo-1-cyclohexa-1,4-dienyl]acetic Acid
[(2R,3R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2R)-2-hydroxy-3-phenylpropanoate
4-Acetyl-3-hydroxy-5-methylphenyl beta-D-glucopyranoside
(3,5-Dimethoxyphenyl)-(4-methylsulfonyl-1-piperazinyl)methanone
6-(hydroxymethyl)-8-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]pteridine-2,4(3H,8H)-dione
N-(4-chloro-2,5-dimethoxyphenyl)-3-methyl-1-piperidinecarbothioamide
2-[[1-(4-Methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]acetic acid ethyl ester
3-[(2-Chlorophenyl)methyl]-5-methyl-7-(1-pyrrolidinyl)triazolo[4,5-d]pyrimidine
3-{[2-(4-methoxyphenylsulfonyl)oxy]ethyl}-5,5-dimethyldihydro-2(3H)-furanone
1-[4-[2-(2-Propan-2-ylidenehydrazinyl)-4-thiazolyl]phenyl]pyrrolidine-2,5-dione
N-[2-[bis(trideuteriomethyl)amino]cyclohexyl]-3,4-dichloro-N-methylbenzamide
5-Methoxy-3-methyl-2-benzofurancarboxylic acid (3-cyano-4-imino-2-oxopentyl) ester
6-(3-Ethyl-5-methoxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
2-[2-(4-hydroxy-3-methoxybenzylidene)hydrazino]-2-oxo-N-(3-pyridinylmethyl)acetamide
3-methoxy-N-[(Z)-[2-(2,2,2-trifluoroacetyl)cyclopentylidene]amino]benzamide
6-(4-Ethyl-2-methoxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
(2S)-2-amino-6-[[(3R)-4-hydroxy-2-oxo-3-phosphonooxybutyl]amino]hexanoic acid
6-Methylpyrimido[2,1-b:4,3-b]diquinazoline-9,16-dione
9-Acetoxy-4,4-ethylenedioxy-1-methoxycarbonyl-9-methyl-7-oxabicyclo(4.3.0)nonan-8-one
1-deoxy-1-(7-hydroxy-6-methyl-2,4-dioxo-3,4-dihydropteridin-8(2H)-yl)-D-ribitol
(1S,2R,4R,5R,6S,7R,8S,11R)-4,5,7,11-tetrahydroxy-2,7-dimethylspiro[9-oxatricyclo[6.3.1.01,5]dodecane-6,3-oxetane]-2,10-dione
Anisatin, a pure toxic substance isolated from the seeds of a Japanese plant (Illicium anisatum) acts as a picrotoxin-like, non-competitive GABA antagonist. Anisatin suppresses GABA-induced currents in a concentration-dependent manner with an EC50 of ~1.10?μM[1]. Anisatin, a pure toxic substance isolated from the seeds of a Japanese plant (Illicium anisatum) acts as a picrotoxin-like, non-competitive GABA antagonist. Anisatin suppresses GABA-induced currents in a concentration-dependent manner with an EC50 of ~1.10?μM[1].
3,4-Dichloro-N-[(1-dimethylaminocyclohexyl)methyl]benzamide
3,4-Dichloro-N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methylbenzamide
3-(3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)propanoic acid
4,5,10,14-tetrahydroxy-2,6-dimethyl-8,12-dioxatetracyclo[9.3.1.0¹,⁵.0⁶,¹⁰]pentadecane-9,13-dione
(2ar,3s,4ar,5r,6r,8r,8as)-3-bromo-6-methoxy-2a,4a,5,8-tetramethyl-hexahydro-1h-cyclobuta[d]inden-7-one
(1'r,2's,3r,4's,5's,7's,8's,11's)-4',5',7',11'-tetrahydroxy-2',7'-dimethyl-9'-oxaspiro[oxetane-3,6'-tricyclo[6.3.1.0¹,⁵]dodecane]-4,10'-dione
(1s,2r,4r,5r,9s,10r,11s,12s,13r)-2-hydroperoxy-4,11,12-trihydroxy-2,11-dimethyl-6-methylidene-8,14-dioxatetracyclo[8.4.0.0¹,¹³.0⁵,⁹]tetradecan-7-one
3-(4-hydroxy-2-methoxyphenyl)-4,7-dimethoxychromen-2-one
(3r)-3',5-dihydroxy-4',7-dimethoxy-2h-spiro[1-benzopyran-3,7'-bicyclo[4.2.0]octane]-1',3',5'-trien-4-one
4,6-dimethoxy-3-[4-oxo-6-(prop-1-en-1-yl)pyran-3-yl]-3h-2-benzofuran-1-one
(2s)-5,9,10-trihydroxy-1,1,2-trimethyl-2h-furo[2,3-c]xanthen-6-one
(2s,3r,4s,5s,6r)-2-{2-hydroxy-4-[(1e)-3-hydroxyprop-1-en-1-yl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
4',5',7',11'-tetrahydroxy-2',7'-dimethyl-9'-oxaspiro[oxetane-3,6'-tricyclo[6.3.1.0¹,⁵]dodecane]-4,10'-dione
2,4-dihydroxy-6-methyl-8-[(2s,3s,4r)-2,3,4,5-tetrahydroxypentyl]pteridin-7-one
(2e)-3-[(2r,3r)-2-(3,4-dihydroxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]prop-2-enal
2,4-dihydroxy-6-methyl-8-(2,3,4,5-tetrahydroxypentyl)pteridin-7-one
(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-(hydroxymethyl)phenoxy]oxan-3-yl acetate
7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,7ah-cyclopenta[c]pyran-5-one
2,6,8-trihydroxy-1-[(2s)-2-hydroxy-3-methylbut-3-en-1-yl]xanthen-9-one
3-hydroxy-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methyl]-5-methoxyfuran-2-one
(12s)-6,15-dihydroxy-8,12,13,13-tetramethyl-3,11-dioxatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁴]hexadeca-1(16),5,7,9,14-pentaene-2,4-dione
(1s,2r,4r,5r,6s,10r,11s,14r)-4,5,10,14-tetrahydroxy-2,6-dimethyl-8,12-dioxatetracyclo[9.3.1.0¹,⁵.0⁶,¹⁰]pentadecane-9,13-dione
1-(3-methoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethanone
4,7-dihydroxy-6-methyl-8-[(2r,3r,4s)-2,3,4,5-tetrahydroxypentyl]pteridin-2-one
1,3,6,7-tetrahydroxy-8-(3-methyl-2-butenyl)-9h-xanthen-9-one
{"Ingredient_id": "HBIN001081","Ingredient_name": "1,3,6,7-tetrahydroxy-8-(3-methyl-2-butenyl)-9h-xanthen-9-one","Alias": "NA","Ingredient_formula": "C18H16O6","Ingredient_Smile": "CC(=CCC1=C2C(=CC(=C1O)O)OC3=CC(=CC(=C3C2=O)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21117","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1β,2β-epoxy-10α-hydroperoxy-3β,4α,8β-trihydroxyguaia-11(13)-en-12,6α-olide
{"Ingredient_id": "HBIN002354","Ingredient_name": "1\u03b2,2\u03b2-epoxy-10\u03b1-hydroperoxy-3\u03b2,4\u03b1,8\u03b2-trihydroxyguaia-11(13)-en-12,6\u03b1-olide","Alias": "NA","Ingredient_formula": "C15H20O8","Ingredient_Smile": "CC1(CC(C2C(C3C14C(O4)C(C3(C)O)O)OC(=O)C2=C)O)OO","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7106","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,10-dioxatricyclo[6.2.1.0 5,11 ]undecane-6,7,8-triol
{"Ingredient_id": "HBIN003523","Ingredient_name": "2,10-dioxatricyclo[6.2.1.0 5,11 ]undecane-6,7,8-triol","Alias": "NA","Ingredient_formula": "C15H20O8","Ingredient_Smile": "NA","Ingredient_weight": "328.31","OB_score": "NA","CAS_id": "103744-68-9","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9038","PubChem_id": "NA","DrugBank_id": "NA"}
2'-hydroxy-5,6,7-trim ethoxyisoflavonoid
{"Ingredient_id": "HBIN005760","Ingredient_name": "2'-hydroxy-5,6,7-trim ethoxyisoflavonoid","Alias": "NA","Ingredient_formula": "C18H16O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10798","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-methoxy-3-methyl-4,6-dihydroxy-5(3'-hydroxyl)cinnamoylbenzaldehyde
{"Ingredient_id": "HBIN005878","Ingredient_name": "2-methoxy-3-methyl-4,6-dihydroxy-5(3'-hydroxyl)cinnamoylbenzaldehyde","Alias": "NA","Ingredient_formula": "C18H16O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31566","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-hydroxy-5,7,4 ′-trimethoxyflavone
{"Ingredient_id": "HBIN008678","Ingredient_name": "3-hydroxy-5,7,4 \u2032-trimethoxyflavone","Alias": "NA","Ingredient_formula": "C18H16O6","Ingredient_Smile": "COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3OC)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10789","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5,7-dihydroxy-3',4'-dimethoxyspiro{2h-1-ben-zopyran-7'-bicyclo[4.2.0]octa[1,3,5]-trien}-4-one
{"Ingredient_id": "HBIN011277","Ingredient_name": "5,7-dihydroxy-3',4'-dimethoxyspiro{2h-1-ben-zopyran-7'-bicyclo[4.2.0]octa[1,3,5]-trien}-4-one","Alias": "NA","Ingredient_formula": "C18H16O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5837","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5-hydroxy-2',6,7-trimethoxyflavone
{"Ingredient_id": "HBIN011586","Ingredient_name": "5-hydroxy-2',6,7-trimethoxyflavone","Alias": "NA","Ingredient_formula": "C18H16O6","Ingredient_Smile": "NA","Ingredient_weight": "328.321","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7675","PubChem_id": "NA","DrugBank_id": "NA"}
5-hydroxy-7, 8, 4′-trimethoxyflavone
{"Ingredient_id": "HBIN011649","Ingredient_name": "5-hydroxy-7, 8, 4\u2032-trimethoxyflavone","Alias": "NA","Ingredient_formula": "C18H16O6","Ingredient_Smile": "COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3O)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41103","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
8-hydroxy-5,7,4'-trimethoxyflavone
{"Ingredient_id": "HBIN013765","Ingredient_name": "8-hydroxy-5,7,4'-trimethoxyflavone","Alias": "NA","Ingredient_formula": "C18H16O6","Ingredient_Smile": "COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3OC)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10795","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
anisatin
{"Ingredient_id": "HBIN016181","Ingredient_name": "anisatin","Alias": "NA","Ingredient_formula": "C15H20O8","Ingredient_Smile": "CC1CC(C2(C13CC(C(C24COC4=O)(C)O)OC(=O)C3O)O)O","Ingredient_weight": "328.31 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1283","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "44575426","DrugBank_id": "NA"}
βetagarin
{"Ingredient_id": "HBIN018099","Ingredient_name": "\u03b2etagarin","Alias": "NA","Ingredient_formula": "C18H16O6","Ingredient_Smile": "COC1=CC=CC=C1C2CC(=O)C3=C(C4=C(C=C3O2)OCO4)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2317","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
