Exact Mass: 272.1313
Exact Mass Matches: 272.1313
Found 208 metabolites which its exact mass value is equals to given mass value 272.1313,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
sempervirin
2,3,4,13- Tetrahydro-1H-benz(g)indolo(2,3-a)quinolizin-6-ium, hydroxide, inner salt
Sempervirine is a member of beta-carbolines. Sempervirene is a natural product found in Gelsemium sempervirens, Mostuea brunonis, and Gelsemium elegans with data available.
ACMC-20n6an
2,2-Dimethyl-8-(3-methylbut-2-en-1-yl)-2H-1-benzopyran-6-carboxylic acid
2,2-Dimethyl-8-prenylchromene 6-carboxylic acid is a 1-benzopyran. 2,2-Dimethyl-8-prenylchromene 6-carboxylic acid is a natural product found in Piper aduncum and Piper hispidum with data available.
Procaine hydrochloride
Procaine hydrochloride
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent
(S)-Verimol F
1,1-bis(4-methoxyphenyl)propan-2-ol
(S)-Verimol F is found in fruits. (S)-Verimol F is a constituent of Illicium verum (Chinese star anise). Constituent of Illicium verum (Chinese star anise). (S)-Verimol F is found in fruits.
Decarbamoylneosaxitoxin
4-(hydroxymethyl)-2,6-diimino-decahydropyrrolo[1,2-c]purine-5,10,10-triol
Decarbamoylneosaxitoxin is isolated from the crab Zosimus aeneus. Isolated from the crab Zosimus aeneus.
threo-3-(4-Hydroxy-3,5-dimethoxyphenyl)-3-ethoxypropane-1,2-diol
threo-3-(4-Hydroxy-3,5-dimethoxyphenyl)-3-ethoxypropane-1,2-diol
Linderene acetate
Linderene acetate
Linderene acetate, isolated from the root of Lindera strychnifolia, is a prolyl endopeptidase inhibitor[1]. Linderene acetate, isolated from the root of Lindera strychnifolia, is a prolyl endopeptidase inhibitor[1].
6-Acetoxy-piliformic-acid
6-Acetoxy-piliformic-acid
[Raw Data] CBA55_6-Acetoxy-pi_pos_50eV.txt [Raw Data] CBA55_6-Acetoxy-pi_pos_40eV.txt [Raw Data] CBA55_6-Acetoxy-pi_pos_30eV.txt [Raw Data] CBA55_6-Acetoxy-pi_pos_20eV.txt [Raw Data] CBA55_6-Acetoxy-pi_pos_10eV.txt
12,13-dihydroxy-3,8,11,13-celastratrtraen-7-one|celahypodiol
12,13-dihydroxy-3,8,11,13-celastratrtraen-7-one|celahypodiol
3,5-Dimethyl-4-(methoxymethyl)-9-methoxy-5,6-dihydronaphtho[2,3-b]furan
3,5-Dimethyl-4-(methoxymethyl)-9-methoxy-5,6-dihydronaphtho[2,3-b]furan
Tensyuic acid C
2-(6-ethoxy-6-oxohexyl)-3-methylenesuccinic acid
A tensyuic acid that is tensyuic acid B in which the methyl ester group has been replaced by an ethyl ester group. The (-) isomer. In contrast to (inactive) tensyuic acid B, tensyuic acid C shows moderate antimicrobial activity against Bacillus subtilis.
(5beta,10alpha)-12-hydroxy-3,4-seco-podocarpa-4(18),6,8,11,13-pentaen-3-oic acid|6,7-dehydromoluccanic acid
(5beta,10alpha)-12-hydroxy-3,4-seco-podocarpa-4(18),6,8,11,13-pentaen-3-oic acid|6,7-dehydromoluccanic acid
3-Hydrocy-8-isopropyl-7-methoxy-5-methyl-2-naphthaldehyde
3-Hydrocy-8-isopropyl-7-methoxy-5-methyl-2-naphthaldehyde
(+-)-Calcalol-acetat|(S)-5,6,7,8-tetrahydro-3,4,5-trimethylnaphtho[2,3-b]furan-9-yl acetate|cacalol acetate|cacalol acetete|Cacalolacetat|cacalolacetate|O-Acetyl-cacalol
(+-)-Calcalol-acetat|(S)-5,6,7,8-tetrahydro-3,4,5-trimethylnaphtho[2,3-b]furan-9-yl acetate|cacalol acetate|cacalol acetete|Cacalolacetat|cacalolacetate|O-Acetyl-cacalol
3-hydroxy-8-acetoxypentadeca-1,9,14-trien-4,6-diyne|8-Ac-(Z)-1,9,14-Pentadecatriene-4,6-diyne-3,8-diol|8-Acetoxy-pentadeca-1,6c,14-trien-9,11-diin-13-ol
3-hydroxy-8-acetoxypentadeca-1,9,14-trien-4,6-diyne|8-Ac-(Z)-1,9,14-Pentadecatriene-4,6-diyne-3,8-diol|8-Acetoxy-pentadeca-1,6c,14-trien-9,11-diin-13-ol
7,10-Dihydroxy-8,9-epoxy-heptadec-1-en-11,13,15-triin
7,10-Dihydroxy-8,9-epoxy-heptadec-1-en-11,13,15-triin
2-(2,4-dihydroxy-5-methylphenyl)-2-(3-hydroxy-4-methylphenyl)propane
2-(2,4-dihydroxy-5-methylphenyl)-2-(3-hydroxy-4-methylphenyl)propane
2,3,4,13-tetrahydro-1H-benz[g]indolo[2,3-a]quinolizine|sempervirine
2,3,4,13-tetrahydro-1H-benz[g]indolo[2,3-a]quinolizine|sempervirine
(1,8E,13Z,16)-heptadecatetraene-4,6-diyne-3,11,12-triol
(1,8E,13Z,16)-heptadecatetraene-4,6-diyne-3,11,12-triol
2, 5-Di-Me ether-1-(3, 5-Dihydroxy-2-methylphenyl)-2-(2-hydroxypyenyl)ethane|3-hydroxy-2,5-dimethoxy-2-methylbibenzyl
2, 5-Di-Me ether-1-(3, 5-Dihydroxy-2-methylphenyl)-2-(2-hydroxypyenyl)ethane|3-hydroxy-2,5-dimethoxy-2-methylbibenzyl
(-)-(4aR,8aR)-15-acetoxytubipofuran|(4aR,8aR)-15-acetoxytubipofuran|(4aR,8aR)-4,4a,8a,9-tetrahydro-3,8a-dimethylnaphtho[2,3-b]furan-5-methanol acetate|15-acetoxytubipofuran
(-)-(4aR,8aR)-15-acetoxytubipofuran|(4aR,8aR)-15-acetoxytubipofuran|(4aR,8aR)-4,4a,8a,9-tetrahydro-3,8a-dimethylnaphtho[2,3-b]furan-5-methanol acetate|15-acetoxytubipofuran
3-Hydroxy-2-(5-phenylpentanoyl)-2-cyclohexen-1-one
3-Hydroxy-2-(5-phenylpentanoyl)-2-cyclohexen-1-one
(all-E)-3-Hydroxy-7,9,15-heptadecatriene-11,13-diynoic acid
(all-E)-3-Hydroxy-7,9,15-heptadecatriene-11,13-diynoic acid
Tensyuic acid D
9-methoxy-3-(methoxycarbonyl)-2-methylene-9-oxononanoic acid
A tensyuic acid that is tensyuic acid B in which the non-conjugated carboxy group has been converted to the corresponding methyl ester. The (+)-isomer, isolated from Aspergillus niger FKI-2342.
Lindeneyl acetate
Cycloprop[2,3]indeno[5,6-b]furan-4-ol, 4,4a,5,5a,6,6a,6b,7-octahydro-3,6b-dimethyl-5-methylene-, acetate, (4R,4aS,5aS,6aR,6bS)-
Linderene acetate is a natural product found in Lindera chunii with data available. Linderene acetate, isolated from the root of Lindera strychnifolia, is a prolyl endopeptidase inhibitor[1]. Linderene acetate, isolated from the root of Lindera strychnifolia, is a prolyl endopeptidase inhibitor[1].
(R)-2-(3-(TERT-BUTOXYCARBONYLAMINO)-2-OXOPIPERIDIN-1-YL)ACETIC ACID
(R)-2-(3-(TERT-BUTOXYCARBONYLAMINO)-2-OXOPIPERIDIN-1-YL)ACETIC ACID
4-AMINO-6-CYANO-3(2H)-QUINAZOLINECARBOXYLIC ACID-1,1-DIMETHYLETHYL ESTER
4-AMINO-6-CYANO-3(2H)-QUINAZOLINECARBOXYLIC ACID-1,1-DIMETHYLETHYL ESTER
(6-HYDROXY-5-(TETRAHYDRO-2H-PYRAN-2-YL)NAPHTHALEN-2-YL)BORONIC ACID
(6-HYDROXY-5-(TETRAHYDRO-2H-PYRAN-2-YL)NAPHTHALEN-2-YL)BORONIC ACID
4-(3-(2-METHOXY-4-METHYLPHENYL)PROPYL)BENZENE-1,3-DIOL
4-(3-(2-METHOXY-4-METHYLPHENYL)PROPYL)BENZENE-1,3-DIOL
2-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)oxazole
2-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)oxazole
2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]-1,3-oxazole
2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]-1,3-oxazole
Bunaprolast
Bunaprolast
C78273 - Agent Affecting Respiratory System > C29712 - Anti-asthmatic Agent C471 - Enzyme Inhibitor > C1322 - Lipooxygenase Inhibitor
ethyl 4-(aminomethyl)-1-cyclopropyl-2,5-dimethylpyrrole-3-carboxylate,hydrochloride
ethyl 4-(aminomethyl)-1-cyclopropyl-2,5-dimethylpyrrole-3-carboxylate,hydrochloride
2-[5-(4-Amino-phenyl)-tetrazol-2-yl]-1-pyrrolidin-1-yl-ethanone
2-[5-(4-Amino-phenyl)-tetrazol-2-yl]-1-pyrrolidin-1-yl-ethanone
ethyl prop-2-enoate,N-(hydroxymethyl)prop-2-enamide,prop-2-enamide
ethyl prop-2-enoate,N-(hydroxymethyl)prop-2-enamide,prop-2-enamide
(S)-2-(3-BOC-AMINO)-2-OXOPIPERIDIN-1-YL)ACETIC ACID
(S)-2-(3-BOC-AMINO)-2-OXOPIPERIDIN-1-YL)ACETIC ACID
2-(4-methyl-piperazin-1-yl)-4-oxo-4h-pyrido[1,2-a]pyrimidine-3-carbaldehyde
2-(4-methyl-piperazin-1-yl)-4-oxo-4h-pyrido[1,2-a]pyrimidine-3-carbaldehyde
2-(6-fluoronaphthalen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2-(6-fluoronaphthalen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
tert-butyl N-[2-amino-2-(2,4-difluorophenyl)ethyl]carbamate
tert-butyl N-[2-amino-2-(2,4-difluorophenyl)ethyl]carbamate
(2-amino-2-phenyl-ethyl)-carbamic acid tert-butyl ester hydrochloride
(2-amino-2-phenyl-ethyl)-carbamic acid tert-butyl ester hydrochloride
2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,4-oxadiazole
2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,4-oxadiazole
2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,4-oxadiazole
2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,4-oxadiazole
tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate
tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate
tert-Butyl 3-(aminomethyl)benzylcarbamate hydrochloride
tert-Butyl 3-(aminomethyl)benzylcarbamate hydrochloride
ethenyl acetate,2-methylidenebutanoic acid,2-methylprop-2-enoic acid
ethenyl acetate,2-methylidenebutanoic acid,2-methylprop-2-enoic acid
[1-(6-Ethoxy-pyriMidin-4-yl)-piperidin-3-yl]-Methyl-aMine hydrochloride
[1-(6-Ethoxy-pyriMidin-4-yl)-piperidin-3-yl]-Methyl-aMine hydrochloride
3-PHENYL-1-(PYRIDIN-2-YL)-6,7-DIHYDRO-5H-CYCLOPENTA[C]PYRIDINE
3-PHENYL-1-(PYRIDIN-2-YL)-6,7-DIHYDRO-5H-CYCLOPENTA[C]PYRIDINE
Benzyl (4-aminobutyl)methylcarbamate hydrochloride (1:1)
Benzyl (4-aminobutyl)methylcarbamate hydrochloride (1:1)
4-(2-Hydroxy-5-methylphenylazo)acetanilide-d3, N-[4-(2-Hydroxy-5-methylphenylazo)phenyl]acetamide-d3
4-(2-Hydroxy-5-methylphenylazo)acetanilide-d3, N-[4-(2-Hydroxy-5-methylphenylazo)phenyl]acetamide-d3
(S)-norcoclaurinium(1+)
(S)-norcoclaurinium(1+)
An organic cation that is the conjugate base of (S)-norcoclaurine: major species at pH 7.3.
norcoclaurine
norcoclaurine
D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D006401 - Hematologic Agents > D005343 - Fibrinolytic Agents D020011 - Protective Agents > D002316 - Cardiotonic Agents D000893 - Anti-Inflammatory Agents D050299 - Fibrin Modulating Agents D002317 - Cardiovascular Agents D018501 - Antirheumatic Agents
[(2S)-3-(4-hydroxyphenyl)-1-oxo-1-phenylmethoxypropan-2-yl]azanium
[(2S)-3-(4-hydroxyphenyl)-1-oxo-1-phenylmethoxypropan-2-yl]azanium
(1R)-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol
(1R)-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol
2,6-diamino-4-(hydroxymethyl)-5-oxido-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-5-ium-10,10-diol
2,6-diamino-4-(hydroxymethyl)-5-oxido-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-5-ium-10,10-diol
Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate
Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate
(4aR,10bS)-8-hydroxy-9-methoxy-3-oxo-4,4a,5,6-tetrahydro-3H-5,10b-ethanophenanthridin-5-ium
(4aR,10bS)-8-hydroxy-9-methoxy-3-oxo-4,4a,5,6-tetrahydro-3H-5,10b-ethanophenanthridin-5-ium
(4aS,10bR)-8-hydroxy-9-methoxy-3-oxo-4,4a,5,6-tetrahydro-3H-5,10b-ethanophenanthridin-5-ium
(4aS,10bR)-8-hydroxy-9-methoxy-3-oxo-4,4a,5,6-tetrahydro-3H-5,10b-ethanophenanthridin-5-ium
2-[(2R,3S,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2R,3S,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2S,3S,6R)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2S,3S,6R)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2S,3R,6R)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2S,3R,6R)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2S,3R,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2S,3R,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2R,3R,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2R,3R,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2S,3S,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2S,3S,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2R,3R,6R)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2R,3R,6R)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
(3aS,4R,10aS)-2-amino-5-hydroxy-4-(hydroxymethyl)-6-imino-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purine-10,10-diol
(3aS,4R,10aS)-2-amino-5-hydroxy-4-(hydroxymethyl)-6-imino-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purine-10,10-diol
Isopropyl 2-(N-((4S)-4-(1-methylethyl)-2-oxazolidinone-3-carbamoyl)(aminoacetate
Isopropyl 2-(N-((4S)-4-(1-methylethyl)-2-oxazolidinone-3-carbamoyl)(aminoacetate
(3-Benzyloxybicyclo[4.1.0]hept-2-en-7-yl)acetic acid methyl ester
(3-Benzyloxybicyclo[4.1.0]hept-2-en-7-yl)acetic acid methyl ester
(4aS,10bR)-noroxomaritidine(1+)
(4aS,10bR)-noroxomaritidine(1+)
An organic cation obtained by protonation of the tertiary amino group of (4aS,10bR)-noroxomaritidine; major species at pH 7.3.
(4aR,10bS)-noroxomaritidine(1+)
(4aR,10bS)-noroxomaritidine(1+)
An organic cation obtained by protonation of the tertiary amino group of (4aR,10bS)-noroxomaritidine; major species at pH 7.3.
(3s)-9-methoxy-3-(methoxycarbonyl)-2-methylidene-9-oxononanoic acid
(3s)-9-methoxy-3-(methoxycarbonyl)-2-methylidene-9-oxononanoic acid
(2r,3as,6s,7as)-2,3a-dihydroxy-4,4,7a-trimethyl-3-oxo-tetrahydro-1-benzofuran-6-yl acetate
(2r,3as,6s,7as)-2,3a-dihydroxy-4,4,7a-trimethyl-3-oxo-tetrahydro-1-benzofuran-6-yl acetate
methyl (2s)-2-amino-4-{[(2s)-3-(hydroxymethyl)-2,5-dihydrofuran-2-yl](methyl)carbamoyl}butanoate
methyl (2s)-2-amino-4-{[(2s)-3-(hydroxymethyl)-2,5-dihydrofuran-2-yl](methyl)carbamoyl}butanoate
(2s,3s)-3',3',6'-trimethyl-1'h,2h-spiro[furan-3,2'-inden]-2-yl acetate
(2s,3s)-3',3',6'-trimethyl-1'h,2h-spiro[furan-3,2'-inden]-2-yl acetate
methyl 2-amino-4-{[3-(hydroxymethyl)-2,5-dihydrofuran-2-yl](methyl)carbamoyl}butanoate
methyl 2-amino-4-{[3-(hydroxymethyl)-2,5-dihydrofuran-2-yl](methyl)carbamoyl}butanoate
(3s,8s,9e)-3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
(3s,8s,9e)-3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
methyl (2r)-2-methyl-4-[(1s,5r,6r)-1,5,6-trihydroxy-4-methyl-2-oxocyclohex-3-en-1-yl]butanoate
methyl (2r)-2-methyl-4-[(1s,5r,6r)-1,5,6-trihydroxy-4-methyl-2-oxocyclohex-3-en-1-yl]butanoate
3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
(1r,10s,11s)-11-methyl-6-(3-methylbut-2-en-1-yl)-12,13-dioxatricyclo[8.2.1.0²,⁷]trideca-2(7),3,5,8-tetraen-3-ol
(1r,10s,11s)-11-methyl-6-(3-methylbut-2-en-1-yl)-12,13-dioxatricyclo[8.2.1.0²,⁷]trideca-2(7),3,5,8-tetraen-3-ol
2-[6-(acetyloxy)hexyl]-3-methylidenebutanedioic acid
2-[6-(acetyloxy)hexyl]-3-methylidenebutanedioic acid
1-(3,5-dihydroxy-2-methylphenyl)-2-(2-hydroxyphenyl)ethane; 2',5-di-me ether
NA
{"Ingredient_id": "HBIN001049","Ingredient_name": "1-(3,5-dihydroxy-2-methylphenyl)-2-(2-hydroxyphenyl)ethane; 2',5-di-me ether","Alias": "NA","Ingredient_formula": "C17H20O3","Ingredient_Smile": "NA","Ingredient_weight": "272.34","OB_score": "NA","CAS_id": "162411-69-0","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9691","PubChem_id": "NA","DrugBank_id": "NA"}
3,4,3'-trimethoxybibenzil
NA
{"Ingredient_id": "HBIN007215","Ingredient_name": "3,4,3'-trimethoxybibenzil","Alias": "NA","Ingredient_formula": "C17H20O3","Ingredient_Smile": "COC1=C(C=C(C=C1)CCC2=CC(=CC=C2)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21883","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,5,3'-trimethoxybibenzil
NA
{"Ingredient_id": "HBIN007533","Ingredient_name": "3,5,3'-trimethoxybibenzil","Alias": "NA","Ingredient_formula": "C17H20O3","Ingredient_Smile": "COC1=CC=CC(=C1)CCC2=CC(=CC(=C2)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21884","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3r,8s)-3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
(3r,8s)-3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
2-methoxy-8a-methyl-5-methylidene-6,7,8,9,10,10a-hexahydroanthracene-1,4-dione
2-methoxy-8a-methyl-5-methylidene-6,7,8,9,10,10a-hexahydroanthracene-1,4-dione
11-methyl-6-(3-methylbut-2-en-1-yl)-12,13-dioxatricyclo[8.2.1.0²,⁷]trideca-2(7),3,5,8-tetraen-3-ol
11-methyl-6-(3-methylbut-2-en-1-yl)-12,13-dioxatricyclo[8.2.1.0²,⁷]trideca-2(7),3,5,8-tetraen-3-ol
2-(6-ethoxy-6-oxohexyl)-3-methylidenebutanedioic acid
2-(6-ethoxy-6-oxohexyl)-3-methylidenebutanedioic acid
(4ar,10ar)-6,7-dihydroxy-1,2,4a-trimethyl-3,4,10,10a-tetrahydrophenanthren-9-one
(4ar,10ar)-6,7-dihydroxy-1,2,4a-trimethyl-3,4,10,10a-tetrahydrophenanthren-9-one
2-hydroxy-3-[(5s,10s)-10-methyl-2,7-dioxooxecan-5-yl]propanoic acid
2-hydroxy-3-[(5s,10s)-10-methyl-2,7-dioxooxecan-5-yl]propanoic acid
(1s,2r,9r,10r,12s)-4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]trideca-3(7),4-dien-2-yl acetate
(1s,2r,9r,10r,12s)-4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]trideca-3(7),4-dien-2-yl acetate
(5s)-9-methoxy-4-(methoxymethyl)-3,5-dimethyl-5h,6h-naphtho[2,3-b]furan
(5s)-9-methoxy-4-(methoxymethyl)-3,5-dimethyl-5h,6h-naphtho[2,3-b]furan
(3r,4s,5r)-3-hydroxy-8-oxo-1,7-dioxaspiro[4.4]nonan-4-yl hexanoate
(3r,4s,5r)-3-hydroxy-8-oxo-1,7-dioxaspiro[4.4]nonan-4-yl hexanoate
9-methoxy-4-(methoxymethyl)-3,5-dimethyl-5h,6h-naphtho[2,3-b]furan
9-methoxy-4-(methoxymethyl)-3,5-dimethyl-5h,6h-naphtho[2,3-b]furan
2,3a-dihydroxy-4,4,7a-trimethyl-3-oxo-tetrahydro-1-benzofuran-6-yl acetate
2,3a-dihydroxy-4,4,7a-trimethyl-3-oxo-tetrahydro-1-benzofuran-6-yl acetate
9-methoxy-3-(methoxycarbonyl)-2-methylidene-9-oxononanoic acid
9-methoxy-3-(methoxycarbonyl)-2-methylidene-9-oxononanoic acid
{[(5s)-3-(ethylimino)-5-hydroxy-5-(hydroxymethyl)-2-methoxycyclohex-1-en-1-yl]amino}acetic acid
{[(5s)-3-(ethylimino)-5-hydroxy-5-(hydroxymethyl)-2-methoxycyclohex-1-en-1-yl]amino}acetic acid
5-methoxy-3-[2-(2-methoxyphenyl)ethyl]-2-methylphenol
5-methoxy-3-[2-(2-methoxyphenyl)ethyl]-2-methylphenol
(4as)-6,7-dihydroxy-1,1,4a-trimethyl-3,4-dihydro-2h-phenanthren-9-one
(4as)-6,7-dihydroxy-1,1,4a-trimethyl-3,4-dihydro-2h-phenanthren-9-one
(1s,2r,9s,10r,12s)-4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]trideca-3(7),4-dien-2-yl acetate
(1s,2r,9s,10r,12s)-4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]trideca-3(7),4-dien-2-yl acetate
(2e)-5-[(2s)-6-hydroxy-2,8-dimethylchromen-2-yl]-2-methylpent-2-enal
(2e)-5-[(2s)-6-hydroxy-2,8-dimethylchromen-2-yl]-2-methylpent-2-enal
4,7,7-trimethyl-5-oxobicyclo[2.2.1]heptan-2-yl benzoate
4,7,7-trimethyl-5-oxobicyclo[2.2.1]heptan-2-yl benzoate
(1r,4r,5s,7r,8s)-4,7-dihydroxy-7-pentyl-2,6,10-trioxatricyclo[6.3.0.0¹,⁵]undecan-9-one
(1r,4r,5s,7r,8s)-4,7-dihydroxy-7-pentyl-2,6,10-trioxatricyclo[6.3.0.0¹,⁵]undecan-9-one
2,2-dimethyl-8-(3-methylbut-2-en-1-yl)chromene-6-carboxylic acid
2,2-dimethyl-8-(3-methylbut-2-en-1-yl)chromene-6-carboxylic acid
(2r)-2-methyl-2-(4-methylpent-3-en-1-yl)chromene-6-carboxylic acid
(2r)-2-methyl-2-(4-methylpent-3-en-1-yl)chromene-6-carboxylic acid
(2r)-2-(6-ethoxy-6-oxohexyl)-3-methylidenebutanedioic acid
(2r)-2-(6-ethoxy-6-oxohexyl)-3-methylidenebutanedioic acid
3-ethoxy-3-(4-hydroxy-3,5-dimethoxyphenyl)propane-1,2-diol
3-ethoxy-3-(4-hydroxy-3,5-dimethoxyphenyl)propane-1,2-diol
methyl 2-methyl-4-(1,5,6-trihydroxy-4-methyl-2-oxocyclohex-3-en-1-yl)butanoate
methyl 2-methyl-4-(1,5,6-trihydroxy-4-methyl-2-oxocyclohex-3-en-1-yl)butanoate
(2s,4e)-2-{[(4s)-4-amino-4-carboxy-1-hydroxybutylidene]amino}-4-methylhex-4-enoic acid
(2s,4e)-2-{[(4s)-4-amino-4-carboxy-1-hydroxybutylidene]amino}-4-methylhex-4-enoic acid
(3s,8s,9z)-3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
(3s,8s,9z)-3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
(9s)-4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]trideca-3(7),4-dien-2-yl acetate
(9s)-4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]trideca-3(7),4-dien-2-yl acetate
(1s,10r,11s)-11-methyl-6-(3-methylbut-2-en-1-yl)-12,13-dioxatricyclo[8.2.1.0²,⁷]trideca-2(7),3,5,8-tetraen-3-ol
(1s,10r,11s)-11-methyl-6-(3-methylbut-2-en-1-yl)-12,13-dioxatricyclo[8.2.1.0²,⁷]trideca-2(7),3,5,8-tetraen-3-ol
(8as,10as)-2-methoxy-8a-methyl-5-methylidene-6,7,8,9,10,10a-hexahydroanthracene-1,4-dione
(8as,10as)-2-methoxy-8a-methyl-5-methylidene-6,7,8,9,10,10a-hexahydroanthracene-1,4-dione
5-(6-hydroxy-2,8-dimethylchromen-2-yl)-2-methylpent-2-enal
5-(6-hydroxy-2,8-dimethylchromen-2-yl)-2-methylpent-2-enal
2-methyl-2-(4-methylpent-3-en-1-yl)chromene-6-carboxylic acid
2-methyl-2-(4-methylpent-3-en-1-yl)chromene-6-carboxylic acid
(5s)-3,4,5-trimethyl-5h,6h,7h,8h-naphtho[2,3-b]furan-9-yl acetate
(5s)-3,4,5-trimethyl-5h,6h,7h,8h-naphtho[2,3-b]furan-9-yl acetate
(2r,3r)-2,3-dihydroxy-3-(5-oxo-2h-furan-3-yl)propyl hexanoate
(2r,3r)-2,3-dihydroxy-3-(5-oxo-2h-furan-3-yl)propyl hexanoate
(2r,3s)-3-ethoxy-3-(4-hydroxy-3,5-dimethoxyphenyl)propane-1,2-diol
(2r,3s)-3-ethoxy-3-(4-hydroxy-3,5-dimethoxyphenyl)propane-1,2-diol
heptadeca-1,8,13,16-tetraen-4,6-diyne-3,11,12-triol
heptadeca-1,8,13,16-tetraen-4,6-diyne-3,11,12-triol
(3as,4r,10as)-4-(hydroxymethyl)-2,6-diimino-hexahydro-1h-pyrrolo[1,2-c]purine-9,10,10-triol
(3as,4r,10as)-4-(hydroxymethyl)-2,6-diimino-hexahydro-1h-pyrrolo[1,2-c]purine-9,10,10-triol
(3r,8s,9z)-3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
(3r,8s,9z)-3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
(1r,2r,4r)-4,7,7-trimethyl-5-oxobicyclo[2.2.1]heptan-2-yl benzoate
(1r,2r,4r)-4,7,7-trimethyl-5-oxobicyclo[2.2.1]heptan-2-yl benzoate
(1s,3e)-1-(furan-3-yl)-4,8-dimethylnona-3,7-dien-5-yn-1-yl acetate
(1s,3e)-1-(furan-3-yl)-4,8-dimethylnona-3,7-dien-5-yn-1-yl acetate
(1s,2r,9s,10s,12r)-4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]trideca-3(7),4-dien-2-yl acetate
(1s,2r,9s,10s,12r)-4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]trideca-3(7),4-dien-2-yl acetate
(6s,7r)-7-ethenyl-2-methoxy-7-methyl-6-(prop-1-en-2-yl)-6,8-dihydro-5h-naphthalene-1,4-dione
(6s,7r)-7-ethenyl-2-methoxy-7-methyl-6-(prop-1-en-2-yl)-6,8-dihydro-5h-naphthalene-1,4-dione
7-ethenyl-2-methoxy-7-methyl-6-(prop-1-en-2-yl)-6,8-dihydro-5h-naphthalene-1,4-dione
7-ethenyl-2-methoxy-7-methyl-6-(prop-1-en-2-yl)-6,8-dihydro-5h-naphthalene-1,4-dione
(3s,8s)-3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
(3s,8s)-3-hydroxypentadeca-1,9,14-trien-4,6-diyn-8-yl acetate
(2s,3s)-3-ethoxy-3-(4-hydroxy-3,5-dimethoxyphenyl)propane-1,2-diol
(2s,3s)-3-ethoxy-3-(4-hydroxy-3,5-dimethoxyphenyl)propane-1,2-diol
(8as,10ar)-2-methoxy-5,8a-dimethyl-8,9,10,10a-tetrahydro-7h-anthracene-1,4-dione
(8as,10ar)-2-methoxy-5,8a-dimethyl-8,9,10,10a-tetrahydro-7h-anthracene-1,4-dione
4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]trideca-3(7),4-dien-2-yl acetate
4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]trideca-3(7),4-dien-2-yl acetate
3-hydroxy-2-(5-phenylpentanoyl)cyclohex-2-en-1-one
3-hydroxy-2-(5-phenylpentanoyl)cyclohex-2-en-1-one
4,7-dihydroxy-7-pentyl-2,6,10-trioxatricyclo[6.3.0.0¹,⁵]undecan-9-one
4,7-dihydroxy-7-pentyl-2,6,10-trioxatricyclo[6.3.0.0¹,⁵]undecan-9-one
3,4,5-trimethyl-5h,6h,7h,8h-naphtho[2,3-b]furan-9-yl acetate
3,4,5-trimethyl-5h,6h,7h,8h-naphtho[2,3-b]furan-9-yl acetate
(5r,5ar,6s)-1,5-dimethyl-8-methylidene-4h,5h,5ah,6h,7h-naphtho[2,1-b]furan-6-yl acetate
(5r,5ar,6s)-1,5-dimethyl-8-methylidene-4h,5h,5ah,6h,7h-naphtho[2,1-b]furan-6-yl acetate
{[(3e,5s)-3-(ethylimino)-5-hydroxy-5-(hydroxymethyl)-2-methoxycyclohex-1-en-1-yl]amino}acetic acid
{[(3e,5s)-3-(ethylimino)-5-hydroxy-5-(hydroxymethyl)-2-methoxycyclohex-1-en-1-yl]amino}acetic acid
2-methoxy-5,8a-dimethyl-8,9,10,10a-tetrahydro-7h-anthracene-1,4-dione
2-methoxy-5,8a-dimethyl-8,9,10,10a-tetrahydro-7h-anthracene-1,4-dione
6,7-dihydroxy-1,2,4a-trimethyl-3,4,10,10a-tetrahydrophenanthren-9-one
6,7-dihydroxy-1,2,4a-trimethyl-3,4,10,10a-tetrahydrophenanthren-9-one
2-[(4-amino-4-carboxy-1-hydroxybutylidene)amino]-4-methylhex-4-enoic acid
2-[(4-amino-4-carboxy-1-hydroxybutylidene)amino]-4-methylhex-4-enoic acid
(2s)-2-[6-(acetyloxy)hexyl]-3-methylidenebutanedioic acid
(2s)-2-[6-(acetyloxy)hexyl]-3-methylidenebutanedioic acid
(3s,8e,11r,12s,13z)-heptadeca-1,8,13,16-tetraen-4,6-diyne-3,11,12-triol
(3s,8e,11r,12s,13z)-heptadeca-1,8,13,16-tetraen-4,6-diyne-3,11,12-triol
