Exact Mass: 316.1109
Exact Mass Matches: 316.1109
Found 500 metabolites which its exact mass value is equals to given mass value 316.1109
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Hydroxytyrosol 1-O-glucoside
Hydroxytyrosol 1-O-glucoside is found in fruits. Hydroxytyrosol 1-O-glucoside is a constituent of Prunus sp. Constituent of Prunus species Hydroxytyrosol 1-O-glucoside is found in fruits.
Vanilloloside
Vanilloloside is found in herbs and spices. Vanilloloside is isolated from unripe vanilla pod. Isolated from unripe vanilla pods. Vanilloloside is found in herbs and spices.
N,N'-Bis(salicylidene)-1,2-phenylenediamine
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
(E)-N-(3-(3-(4-Fluorophenoxy)phenyl)-1-(R,S)-methylprop-2-enyl)-N-hydroxyurea
Cornoside
Cornoside is a member of the class of compounds known as O-glycosyl compounds. O-glycosyl compounds are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond. Cornoside is soluble (in water) and a very weakly acidic compound (based on its pKa). Cornoside can be found in olive, which makes cornoside a potential biomarker for the consumption of this food product.
Hydroxytyrosol 4'-O-glucoside
Hydroxytyrosol 4-o-glucoside is a member of the class of compounds known as phenolic glycosides. Phenolic glycosides are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose. Hydroxytyrosol 4-o-glucoside is soluble (in water) and a very weakly acidic compound (based on its pKa). Hydroxytyrosol 4-o-glucoside can be found in olive, which makes hydroxytyrosol 4-o-glucoside a potential biomarker for the consumption of this food product.
3,5-Dihydroxyphenethyl alcohol 3-O-beta-glucopyranoside
2-(2-Hydroxy-3-methoxy-5-methylbenzoyl)-4-hydroxy-6-methoxybenzaldehyde
Xanthocillin X dimethyl ether
Xanthocillin X permethyl ether is a natural compound isolated from fungal extracts, with Aβ-42 lowering activity[1].
7-Methoxy-8-(2-acetoxy-3-methyl-1-oxobut-2-enyl) coumarin
2,4-dihydroxy-6-methoxy-3,4-methylenedioxydihydrochalcone
Cajanol
A hydroxyisoflavanone that is (3S)-isoflavanone substituted by hydroxy groups at positions 5 and 4 and methoxy groups at positions 7 and 2 respectively. It has been isolated from Crotalaria lachnophora.
Homoferreirin
A dihydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5 and 7 and methoxy groups at positions 2 and 4 respectively.
Nanaomycin A methyl ester
(Z)-5-methoxytrichoclin|5-methoxy-8-(3-hydroxymethyl-but-2-enyloxy)psoralen|Methoxy-8-(3-hydroxymethyl-but-2-enyloxy)-psoralen
3-methoxy-6-methyl-5,7,4-trihydroxyflavanone|6-methyl homoeriodictyol
2-Phenethyl-4-[(E)-(1H-indole-3-yl)methylene]-2-oxazoline-5-one
4-beta-D-glucosyl-3-hydroxyphenylethanol|hydroxytyrosol 4-beta-D-glucoside
1-(2-Hydroxy-4,6-dimethoxyphenyl)-3-(4-hydroxyphenyl)-1,3-propanedione
(3R,4S,6S,10R)-10-bromo-3,11,11-trimethyl-7-methylidenespiro[5.5]undecane-3,4-diol
4-Hydroxy-gammar-snyderol|8-Hydroxy-gamma-snyderol
6-methyl-2,4-dihydroxyphenyl-4-O-methyl-1-beta-D-glucopyranoside
7-Methoxy-8-(1-acetoxy-3-methyl-2-oxo-3-butenyl)-2H-1-benzopyran-2-one
4,6-Di-Me ether-1-(4-Hydroxyphenyl)-3-(2,4,6-trihydroxyphenyl)-1,3-propanedione|4,6-dimethoxy-beta,4,2-trihydroxy-(Z)-chalcone
(5R*,8S*,9S*)-9-(3,4-dihydroxyphenyl)-6,7,8,9-tetrahydro-5H-5,8-epoxybenzo[7]annulene-2,3,9-triol|sinensigenin A
3-methoxy-1,4-hydroquinone 1-(4-O-methyl-beta-glucopyranoside)|4-hydroxy-3-methoxyphenyl 4-O-methyl-beta-glucopyranoside
O-??-D-Glucopyranoside-4-Hydroxy-2-isopropylidene-5-methyl-3(2H)-furanone
5,6-Dimethoxy-7-phenyl-phenalenon|5,6-Dimethoxy-7-phenylalenon|Lachnanthocarpondimethylether
4,4-dihydroxy-2-methyl-3-[(4-hydroxyphenyl)ethynyl]biphene|selaginellin L
(2R,3R)-3,7-dihydroxy-5,6-dimethoxyflavanone|pisonivanol
9-methoxy-4-(3-methyl-2-oxo-butoxy)-furo[3.2g]chromane-7-one
(3R)-5,7,8-trihydroxy-3-(4-hydroxybenzyl)-6-methylchroman-4-one|odoratumone B
eleuthinone A|[8-methoxy-1,4-dioxo-3-(2-oxopropyl)-1,4-dihydronaphthalen-2-yl]acetic acid methyl ester
(2E)-1-(3,4-dihydroxyphenyl)-3-(4-hydroxy-2,6-dimethoxyphenyl)prop-2-en-1-one|3,4,4-trihydroxy-2,6-dimethoxychalcone
2,4-dimethoxyphenol 1-O-beta-D-glucoside|2,4-dimethoxyphenyl-1-beta-D-glucoside
1-Hydroxy-3,8-dimethoxy-4-(2-hydroxyethyl)-9H-xanthene-9-one
4-(3,3-Dimethylglycidyloxy)-9-methoxy-7H-furo[3,2-g][1]benzopyran-7-one
4-hydroxy-3-methoxy benzyl-beta-D-glucoside|vanillyl alcohol-7-O-beta-D-glucopyranoside
3-hydroxy-5-methoxy-4-methylphenyl-beta-D-glucopyranoside
(R)-5,6-dihydroxy-7-methoxy-3-(4-hydroxybenzyl)chroman-4-one
3-(3,4-Dihydroxy-phenyl)-acrylic acid 2-(3,4-dihydroxy-phenyl)-ethyl ester
5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydrochromen-4-one
2,7-Anhydro,4,5-O-isopropylidene,1,3-di-Ac-beta-D-Pyranose-altro-2-Heptulose
6-Methoxy-5-(3-hydroxy-2-oxo-3-methyl-butyl)-angelicin
(6aR,11aR)-3,8-dihydroxy-9,10-dimethoxypterocarpan
5,7-Dihydroxy-6-methoxy-3-(alpha-hydroxybenzyl)chroman-4-one
2-Acetyl-6-methyl-6-methoxy-6H-dibenzo[b,d]pyran-1,7,10-triol
8-[(acetyloxy)methyl]-6,9-dihydro-5-hydroxy-2-methyl-4H-pyrano[3,2-h][1]benzoxepin-4-one|prenyletin|Ptaeroxylinolacetat
(1R*,5R*,6R*,8S*,9S*)-8-bromo-1,6-epoxy-5-isopropyl-3,3,9-trimethylbicyclo[4.3.0]nonan-9-ol
3-methoxy-1,4-hydroquinone 4-(4-O-methyl-beta-glucopyranoside)|4-hydroxy-2-methoxyphenyl 4-O-methyl-beta-glucopyranoside
1,2-Dihydro,6,8-di-Me ether-1,3,6,8-Tetrahydroxy-2-methylanthraquinone|1,2-dihydro-1,3-dihydroxy-6,8-dimethoxy-2-methyl-anthraquinone|1,2-dihydro-1,3-dihydroxy-6,8-dimethoxy-2-methylanthraquinone
7-Methoxy-8-(2-acetoxy-3-methyl-2-butenoyl)-2H-1-benzopyran-2-one
methyl 2-(9-hydroxy-1-methyl-5,10-dioxo-3,4-dihydro-1H-benzo[g]isochromen-3-yl)acetate
2-[2-(3,4-dihydroxyphenyl)ethoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
4-(2-hydroxy-3-methylbut-3-enoxy)-9-methoxyfuro[3,2-g]chromen-7-one
C14H20O8_2-Hydroxy-4-(2-hydroxyethyl)phenyl beta-D-glucopyranoside
C14H20O8_beta-D-Glucopyranoside, 4-(hydroxymethyl)-2-methoxyphenyl
methyl 2-(9-hydroxy-1-methyl-5,10-dioxo-3,4-dihydro-1H-benzo[g]isochromen-3-yl)acetate
methyl 2-(9-hydroxy-1-methyl-5,10-dioxo-3,4-dihydro-1H-benzo[g]isochromen-3-yl)acetate_major
Vanilloloside
A natural product found in Acer saccharum.
3-(3,4-Dihydroxybenzyl)-7-hydroxy-5-methoxy-4-chromanone
8-O-Demethyl-7-O-methyl-3,9-dihydropunctatin
3-Hydroxy-3,9-dihydroeucomin
(2S,3S)-3,7,4-trihydroxy-5-methoxy-6-methylflavanone
1-(1,2-difluoro-2-naphthalen-1-ylethenyl)naphthalene
1,1,2,2-Ethenetetracarboxylicacid, 1,1,2,2-tetraethyl ester
1-CYCLOHEXYL-5-(4-METHYLSULFANYL-PHENYL)-1H-PYRAZOLE-3-CARBOXYLIC ACID
2-O-(2-Methoxyethyl)-5-methyluridine
2'-O-MOE-5-Me-rU is an active compound. 2'-O-MOE-5-Me-rU can be used for oligonucleotide synthesis[1].
methyl (E)-3-methoxy-2-[2-(6-methoxypyrimidin-4-yl)oxyphenyl]prop-2-enoate
1-(4-fluorophenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
(4-Furan-2-yl-[4,5]bipyrimidinyl-2-yl)-pyridin-3-yl-amine
tert-butyl 4-[5-(chloromethyl)thiazol-2-yl]piperidine-1-carboxyla te
2-benzofuran-1,3-dione,ethane-1,2-diol,2-(2-hydroxyethoxy)ethanol
[(4-methoxyphenyl)methyl] hydrogen (4-hydroxyphenyl)malonate
6-amino-2-(2,4-dimethylphenyl)-1H-benz[de]isoquinoline-1,3(2H)-dione
Ticarbodine
C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent
Methyl 2-(4’-Acetoxy-2-fluoro-biphenyl-4-yl)-propionate
1-hexyl-3-methylimidazolium trifluoromethanesulfonate
4-Chloro-6-methoxy-7-(4-methyl-1-piperazinyl)-3-quinolinecarbonit rile
JNJ 63533054
JNJ-63533054 is a potent, selective and orally active GPR139 agonist with an EC50 of 16 nM for human GPR139 (hGPR139). JNJ-63533054 shows selective for GPR139 over other GPCRs, ion channels, and transporters. JNJ-63533054 can cross the blood-brain barrier (BBB)[1][2].
methyl 4-(4-ethoxyphenoxycarbonyl)phenyl carbonate
[(2S)-2-[(2R)-4-butanoyloxy-3-hydroxy-5-oxo-2H-furan-2-yl]-2-hydroxyethyl] butanoate
Tinoridine
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents
N-Isobutyl-N-[4-methoxyphenylsulfonyl]glycyl hydroxamic acid
(E)-N-(3-(3-(4-Fluorophenoxy)phenyl)-1-(R,S)-methylprop-2-enyl)-N-hydroxyurea
Pisonivanol
A dihydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 3 and 7 and methoxy groups at positions 5 and 6. It has been isolated from Pisonia aculeata.
2-[[Anilino(oxo)methyl]amino]-4,5-dimethoxybenzoic acid
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-tert-butylbenzamide
1-(2-Chlorophenoxy)-3-(2-methyl-1-benzimidazolyl)-2-propanol
Trisilane, 1,1,1,3,3,3-hexamethyl-2-(trifluoromethyl)-2-(trimethylsilyl)-
Byakangelicol
Byakangelicol, isolated from Angelica dahurica, inhibits interleukin-1beta (IL-1beta) -induced prostaglandin E2 (PGE2) release in A549 cells mediated by suppression of cyclooxygenase-2 (COX-2) expression and the activity of COX-2 enzyme. Byakangelicol has therapeutic potential as an anti-inflammatory agent on airway inflammation[1]. Byakangelicol, isolated from Angelica dahurica, inhibits interleukin-1beta (IL-1beta) -induced prostaglandin E2 (PGE2) release in A549 cells mediated by suppression of cyclooxygenase-2 (COX-2) expression and the activity of COX-2 enzyme. Byakangelicol has therapeutic potential as an anti-inflammatory agent on airway inflammation[1].
2-(3,4-Dimethyloxyphenyl)-2,3-dihydro-5,7-dihydroxy-4H-1-benzopyran-4-one
9-(Chloromethyl)-9-hydroxy-1-oxo-6-propan-2-yl-3,5a,6,7,8,9a-hexahydro-2-benzoxepine-4-carboxylic acid
2-(3,4-dihydroxyphenyl)-ethyl-O-beta-D-glucopyranoside
A beta-D-glucoside having hydroxytyrosol as the anomeric substituent. Isolated from Zantedeschia aethiopica and Picrorhiza scrophulariiflora, it exhibits antioxidant activity.
(3R)-3-(2,4-dimethoxyphenyl)-5,7-dihydroxy-2,3-dihydrochromen-4-one
(2E,3Z)-2,3-bis[(4-methoxyphenyl)methylidene]butanedinitrile
(3S)-5-hydroxy-3-(4-hydroxy-2-methoxyphenyl)-7-methoxy-2,3-dihydro-4H-1-benzopyran-4-one
(2S,3R,4S,5S,6R)-2-[2-hydroxy-4-(2-hydroxyethyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
1-Deoxy-1-({2,6-Dioxo-5-[(E)-(2-Oxoethylidene)amino]-1,2,3,6-Tetrahydropyrimidin-4-Yl}amino)-D-Ribitol
variecolorquinone B
An aromatic ester that is methyl 2-hydroxy-4-methylbenzoate attached to a (6-methoxy-1,4-benzoquinon-2-yl)methyl group at position 6. Isolated from Aspergillus variecolor, it exhibits cytotoxic activity.
2-[1-(2-hydroxybenzyl)-1H-benzimidazol-2-yl]phenol
1-(4-Acetylphenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea
N-(3-fluorophenyl)-2-pyridin-4-yl-4-quinazolinamine
3-Oxo-2-[(6-oxo-1-phenyl-3-pyridazinyl)oxy]butanoic acid ethyl ester
1-[2-[(2-Methylphenyl)methylthio]ethyl]-3-phenylthiourea
N-(3-isoxazolyl)-3-nitro-4-(1-piperidinyl)benzamide
4-[(3-Fluorophenyl)methyl-(3-pyridinylmethyl)amino]-4-oxobutanoic acid
5-hydroxy-3-(4-methylphenyl)-5-(trifluoromethyl)-4H-pyrazole-1-carboxylic acid ethyl ester
2-Furanyl-[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2-yl]methanone
(3S)-9,10-dihydroxy-7-methoxy-3-(2-oxopropyl)-1H,3H,4H-naphtho[2,3-c]pyran-1-one
5-hydroxy-N-[2-[[(5-hydroxy-3-pyridinyl)-oxomethyl]amino]propyl]-3-pyridinecarboxamide
4-(N-(N,N-Dimethylcarbamoyl)amino)phenoxymethyl 3-methylphenyl sulfide
Biacangelicol
Byakangelicol is a member of psoralens. Byakangelicol is a natural product found in Murraya koenigii, Ostericum grosseserratum, and other organisms with data available. Byakangelicol, isolated from Angelica dahurica, inhibits interleukin-1beta (IL-1beta) -induced prostaglandin E2 (PGE2) release in A549 cells mediated by suppression of cyclooxygenase-2 (COX-2) expression and the activity of COX-2 enzyme. Byakangelicol has therapeutic potential as an anti-inflammatory agent on airway inflammation[1]. Byakangelicol, isolated from Angelica dahurica, inhibits interleukin-1beta (IL-1beta) -induced prostaglandin E2 (PGE2) release in A549 cells mediated by suppression of cyclooxygenase-2 (COX-2) expression and the activity of COX-2 enzyme. Byakangelicol has therapeutic potential as an anti-inflammatory agent on airway inflammation[1].
Neobyakangelicol
Neobyakangelicol is a member of psoralens. Neobyakangelicol is a natural product found in Murraya koenigii, Angelica japonica, and other organisms with data available.
2-[2-(3,4-dihydroxyphenyl)ethoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
ACA-28
ACA-28 (compound 2a) is a potent ERK MAPK signaling modulator. ACA-28 selectively inhibits cancer cell growth by inducing apoptosis with ERK hyperactivation ACA-28 inhibits cell growth of melanoma cells (SK-MEL-28) and normal melanocytes (NHEM), with IC50 values of 5.3 and 10.1 μM, respectively[1].
H4 Receptor antagonist 1
H4 Receptor antagonist 1 is a potent and selective histamine H4 receptor inverse agonist, with an IC50 of 19 nM.
(3r)-6-hydroxy-4-methoxy-3-(4-oxo-6-propylpyran-3-yl)-3h-2-benzofuran-1-one
5-[5-(buta-1,3-dien-1-yl)thiophen-2-yl]pent-2-en-4-yn-1-yl 3-hydroxy-3-methylbutanoate
(2e)-n-{1-[(2e)-3-(methylsulfanyl)prop-2-enoyl]pyrrolidin-2-yl}-3-phenylprop-2-enimidic acid
2-hydroxy-1-(hydroxymethyl)-7,8-dimethoxy-3-methylxanthen-9-one
7-hydroxy-3-(5-hydroxy-2,4-dimethoxyphenyl)-2,3-dihydro-1-benzopyran-4-one
(2e)-3-(methylsulfanyl)-n-[(2r)-1-[(2e)-3-phenylprop-2-enoyl]pyrrolidin-2-yl]prop-2-enimidic acid
2-({5-hydroxy-1h,4ah,5h,7ah-cyclopenta[c]pyran-1-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol
3-(6-hydroxy-2h-1,3-benzodioxol-5-yl)-7-methoxy-3,4-dihydro-2h-1-benzopyran-6-ol
methyl 3,6,9-trihydroxy-1-methyl-8-oxo-6,7-dihydro-5h-anthracene-2-carboxylate
2-(2-hydroxy-4,6-dimethoxyphenyl)-7-methoxy-1-benzofuran-6-ol
(6s,7ar)-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6,7,7a-tetrahydro-4h-1-benzofuran-2-one
4-hydroxy-3,7,9-trimethoxy-1-methylbenzo[c]chromen-6-one
3-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-2,3-dihydro-1-benzopyran-4-one
(2r,3r)-3,5-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-methyl-2,3-dihydro-1-benzopyran-4-one
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methyl-2,3-dihydro-1-benzopyran-4-one
(2e)-2,3-bis(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
6,15-dihydroxy-4,7-dimethoxy-13-methyl-9-oxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-one
(1r,10r)-12,14-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-2,4,6,11,13,15-hexaene-5,15-diol
5-bromo-3-(3-hydroxy-3-methylpent-4-en-1-yl)-2,4,4-trimethylcyclohex-2-en-1-ol
(3r,4r,7s,7as)-7-bromo-3-(1-hydroxy-2-methylprop-2-en-1-yl)-4,7a-dimethyl-hexahydro-1h-inden-4-ol
(2s)-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydro-1-benzopyran-4-one
(1s,10r)-6,14-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-2,4,6,11,13,15-hexaene-5,15-diol
4-hydroxy-4-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl)cyclohexa-2,5-dien-1-one
5-hydroxy-2-(2-hydroxy-5-methoxyphenyl)-7-methoxy-2,3-dihydro-1-benzopyran-4-one
(2s,3s)-3,7-dihydroxy-2-(4-hydroxyphenyl)-5-methoxy-6-methyl-2,3-dihydro-1-benzopyran-4-one
6,14-dihydroxy-15-(hydroxymethyl)-4,7,12-trimethyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one
6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6,7,7a-tetrahydro-4h-1-benzofuran-2-one
5-hydroxy-2-(2-hydroxyphenyl)-7,8-dimethoxy-2,3-dihydro-1-benzopyran-4-one
(3s)-5,7-dihydroxy-3-[(3-hydroxy-4-methoxyphenyl)methyl]-2,3-dihydro-1-benzopyran-4-one
(3r)-5,7,8-trihydroxy-3-[(4-hydroxyphenyl)methyl]-6-methyl-2,3-dihydro-1-benzopyran-4-one
methyl 2-methoxy-5-[4-(methoxycarbonyl)phenoxy]benzoate
(3r)-6-[(1e)-4-(thiophen-2-yl)but-1-en-3-yn-1-yl]oxan-3-yl 3-methylbut-2-enoate
methyl (2s,7'r)-3'-formyl-5-hydroxy-3-oxospiro[1-benzofuran-2,1'-cycloheptan]-3'-ene-7'-carboxylate
2-(3,4-dihydroxyphenyl)ethyl 3-(3,4-dihydroxyphenyl)prop-2-enoate
3-methoxy-5a,10,11a,12-tetrahydro-5,11-dioxatetraphene-7,8,12-triol
(2r,3r)-3,8-dihydroxy-5,7-dimethoxy-2-phenyl-2,3-dihydro-1-benzopyran-4-one
7-hydroxy-3-(2-hydroxy-4,5-dimethoxyphenyl)-2,3-dihydro-1-benzopyran-4-one
7-bromo-3-(1-hydroxy-2-methylprop-2-en-1-yl)-4,7a-dimethyl-hexahydro-1h-inden-4-ol
18-hydroxy-8-imino-3,10,20-triazapentacyclo[11.7.1.0²,⁷.0⁹,²¹.0¹⁴,¹⁹]henicosa-1(20),2(7),9,11,13(21),14(19),15,17-octaen-6-one
2-(3,4-dihydroxyphenyl)ethyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate
(3r)-5,7-dihydroxy-3-[(s)-hydroxy(phenyl)methyl]-6-methoxy-2,3-dihydro-1-benzopyran-4-one
methyl (2r,2'r,5's)-5-hydroxy-3-oxo-5'-(3-oxoprop-1-en-2-yl)spiro[1-benzofuran-2,1'-cyclopentane]-2'-carboxylate
(2r,3r,4s,5s,6r)-2-[2-(3,5-dihydroxyphenyl)ethoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
(2s,3r,4s,5r,6r)-2-[2-hydroxy-5-(2-hydroxyethyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
1,8-dihydroxy-3-(3'-hydroxy-butoxy)xanthone
{"Ingredient_id": "HBIN002107","Ingredient_name": "1,8-dihydroxy-3-(3'-hydroxy-butoxy)xanthone","Alias": "NA","Ingredient_formula": "C17H16O6","Ingredient_Smile": "CC(CCOC1=CC(=C2C(=C1)OC3=C(C2=O)C(=CC=C3)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5949","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,3,4,7-tetramethoxyxanthone
{"Ingredient_id": "HBIN003863","Ingredient_name": "2,3,4,7-tetramethoxyxanthone","Alias": "2,3,4,7-tetramethoxy-9-xanthenone; AIDS-073387; AIDS073387; 2,3,4,7-tetramethoxyxanthen-9-one; 9H-Xanthen-9-one, 2,3,4,7-tetramethoxy-; NCI60_014913; NSC643978","Ingredient_formula": "C17H16O6","Ingredient_Smile": "COC1=CC2=C(C=C1)OC3=C(C(=C(C=C3C2=O)OC)OC)OC","Ingredient_weight": "316.3 g/mol","OB_score": "29.24489053","CAS_id": "NA","SymMap_id": "SMIT06104","TCMID_id": "NA","TCMSP_id": "MOL004135","TCM_ID_id": "NA","PubChem_id": "370636","DrugBank_id": "NA"}
2-(3, 4-dihydroxyphenyl)-ethyl-O-β-D-glucopyranoside
{"Ingredient_id": "HBIN003885","Ingredient_name": "2-(3, 4-dihydroxyphenyl)-ethyl-O-\u03b2-D-glucopyranoside","Alias": "2-(3,4-dihydroxyphenyl)-ethyl-O-\u03b2-D-glucopyranoside","Ingredient_formula": "C14H20O8","Ingredient_Smile": "C1=CC(=C(C=C1CCOC2C(C(C(C(O2)CO)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40958;40957","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2s)-5,2'-dihydroxy-7,5'-dimethoxyflavanone
{"Ingredient_id": "HBIN006753","Ingredient_name": "(2s)-5,2'-dihydroxy-7,5'-dimethoxyflavanone","Alias": "NA","Ingredient_formula": "C17H16O6","Ingredient_Smile": "COC1=CC(=C(C=C1)O)C2CC(=O)C3=C(C=C(C=C3O2)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5827","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,5,7-trihydroxy-3-(4 '-methoxybenzyl)-4-chro-manone
{"Ingredient_id": "HBIN007581","Ingredient_name": "3,5,7-trihydroxy-3-(4 '-methoxybenzyl)-4-chro-manone","Alias": "NA","Ingredient_formula": "C17H16O6","Ingredient_Smile": "COC1=C(C=C(C=C1)CC2COC3=CC(=CC(=C3C2=O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21751","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,5-dihydroxyphenethyl alcohol 3-o-β-gluco-pyranoside
{"Ingredient_id": "HBIN007630","Ingredient_name": "3,5-dihydroxyphenethyl alcohol 3-o-\u03b2-gluco-pyranoside","Alias": "NA","Ingredient_formula": "C14H20O8","Ingredient_Smile": "C1=C(C=C(C=C1O)OC2C(C(C(C(O2)CO)O)O)O)CCO","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6073","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5,3'-dihydroxy-7,4'-dimethoxyflavanone
{"Ingredient_id": "HBIN011022","Ingredient_name": "5,3'-dihydroxy-7,4'-dimethoxyflavanone","Alias": "NA","Ingredient_formula": "C17H16O6","Ingredient_Smile": "COC1=C(C=C(C=C1)C2CC(=O)C3=C(C=C(C=C3O2)OC)O)O","Ingredient_weight": "316.3 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "35035","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "139074584","DrugBank_id": "NA"}
aromadendrin-5,7-dimethyl ether
{"Ingredient_id": "HBIN016895","Ingredient_name": "aromadendrin-5,7-dimethyl ether","Alias": "NA","Ingredient_formula": "C17H16O6","Ingredient_Smile": "COC1=CC(=C2C(=C1)OC(C(C2=O)O)C3=CC=C(C=C3)O)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1766","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}