Exact Mass: 316.1342326
Exact Mass Matches: 316.1342326
Found 374 metabolites which its exact mass value is equals to given mass value 316.1342326,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Combretastatin_A-4
Combretastatin A4 is a stilbenoid. Combretastatin A4 is a natural product found in Combretum caffrum with data available. Combretastatin A-4 is an inhibitor of microtubule polymerization derived from the South African willow bush which causes mitotic arrest and selectively targets and reduces or destroys existing blood vessels, causing decreased tumor blood supply. C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C273 - Antimitotic Agent D000970 - Antineoplastic Agents Combretastatin A4 is a microtubule-targeting agent that binds β-tubulin with Kd of 0.4 μM.
Sorgolactone
Sorgolactone is found in cereals and cereal products. Sorgolactone is isolated from the roots of Sorghum bicolor (sorghum) (genuine host plant for Striga species) Strigolactones are plant hormones that have been implicated in inhibition of shoot branching. Strigolactones are carotenoid-derived and trigger germination of parasitic plant seeds (for example striga from which they gained their name) and stimulate symbiotic mycorrhizal fungi. Strigolactones contain a labile ether bond that is easily hydrolysed in the rhizosphere meaning that there is a large concentration gradient between areas near the root and those further away. Isolated from the roots of Sorghum bicolor (sorghum) (genuine host plant for Striga subspecies)
O-Methylodoratol
A member of the class of dihydrochalcones that is the 2-O-methyl derivative of odoratol.
N(beta)-Epoxysuccinamoyl-diaminopropionyl-valine
Verimol A
Verimol A is found in fruits. Verimol A is a constituent of Illicium verum (Chinese star anise). Constituent of Illicium verum (Chinese star anise). Verimol A is found in fruits.
Verimol B
Verimol B is found in fruits. Verimol B is a constituent of Illicium verum (Chinese star anise). Constituent of Illicium verum (Chinese star anise). Verimol B is found in fruits.
7-Hydroxy-2',3',4'-trimethoxyisoflavan
7-Hydroxy-2,3,4-trimethoxyisoflavan is found in alfalfa. 7-Hydroxy-2,3,4-trimethoxyisoflavan is a constituent of Medicago sativa (alfalfa). Constituent of Medicago sativa (alfalfa). 7-Hydroxy-2,3,4-trimethoxyisoflavan is found in alfalfa and pulses.
7-Hydroxy-2',4',5'-trimethoxyisoflavan
7-Hydroxy-2,4,5-trimethoxyisoflavan is found in alfalfa. 7-Hydroxy-2,4,5-trimethoxyisoflavan is isolated from the leaves of Medicago sativa (alfalfa). Isolated from the leaves of Medicago sativa (alfalfa). 7-Hydroxy-2,4,5-trimethoxyisoflavan is found in alfalfa and pulses.
5'-Hydroxy-3',4',7-trimethoxyflavan
5-Hydroxy-3,4,7-trimethoxyflavan is found in fruits. 5-Hydroxy-3,4,7-trimethoxyflavan is a constituent of the roots of Muntingia calabura (Jamaica cherry). Constituent of the roots of Muntingia calabura (Jamaica cherry). 5-Hydroxy-3,4,7-trimethoxyflavan is found in fruits.
8-Hydroxydesmethylclomipramine
8-Hydroxydesmethylclomipramine is a metabolite of clomipramine. Clomipramine (trademarked as Anafranil) is a tricyclic antidepressant (TCA). It was developed in the 1960s by the Swiss drug manufacturer Geigy (now known as Novartis) and has been in clinical use worldwide ever since. (Wikipedia)
Isocombretastatin A4
D000970 - Antineoplastic Agents
Loureirin B
Loureirin B is a natural product found in Garcinia dulcis with data available. Loureirin B, a flavonoid extracted from Dracaena cochinchinensis, is an inhibitor of plasminogen activator inhibitor-1 (PAI-1), with an IC50 of 26.10?μM; Loureirin B also inhibits KATP, the phosphorylation of ERK and JNK, and has anti-diabetic activity. Loureirin B, a flavonoid extracted from Dracaena cochinchinensis, is an inhibitor of plasminogen activator inhibitor-1 (PAI-1), with an IC50 of 26.10?μM; Loureirin B also inhibits KATP, the phosphorylation of ERK and JNK, and has anti-diabetic activity. Loureirin B, a flavonoid extracted from Dracaena cochinchinensis, is an inhibitor of plasminogen activator inhibitor-1 (PAI-1), with an IC50 of 26.10?μM; Loureirin B also inhibits KATP, the phosphorylation of ERK and JNK, and has anti-diabetic activity.
Loureirin
Loureirin B is a natural product found in Garcinia dulcis with data available. Loureirin B, a flavonoid extracted from Dracaena cochinchinensis, is an inhibitor of plasminogen activator inhibitor-1 (PAI-1), with an IC50 of 26.10?μM; Loureirin B also inhibits KATP, the phosphorylation of ERK and JNK, and has anti-diabetic activity. Loureirin B, a flavonoid extracted from Dracaena cochinchinensis, is an inhibitor of plasminogen activator inhibitor-1 (PAI-1), with an IC50 of 26.10?μM; Loureirin B also inhibits KATP, the phosphorylation of ERK and JNK, and has anti-diabetic activity. Loureirin B, a flavonoid extracted from Dracaena cochinchinensis, is an inhibitor of plasminogen activator inhibitor-1 (PAI-1), with an IC50 of 26.10?μM; Loureirin B also inhibits KATP, the phosphorylation of ERK and JNK, and has anti-diabetic activity.
7-Hydroxy-2,3,4,6-tetramethoxy-9,10-dihydrophenanthrene
2-Hydroxy-3,4,6,7-tetramethoxy-9,10-dihydrophenanthrene
3-Hydroxy-2,4,6,7-tetramethoxy-9,10-dihydrophenanthrene
2-(3,5-Dimethoxyphenyl)-3,4-dihydro-7-methoxy-2H-1-benzopyran-5-ol
(2S)-4-Hydroxy-5,7,3-trimethoxyflavan
4,2,6-Trihydroxy-4-methoxy-3,5-dimethyldihydrochalcone
2H-1-Benzopyran-3-ol, 3,4-dihydro-5,7-dimethoxy-2-(4-methoxyphenyl)-
meso-(rel-7S,8S,7R,8R)-3,4,3,4-Tetrahydroxy-7,7-epoxylignan
2,3,6,7-Tetramethoxy-9,10-dihydrophenanthrene-4-ol
6-O-Nicotinoyltetrahydrocantleyine|O-nicotinoyl-6-tetrahydrocantleyine
C17H20N2O4 (316.14230000000003)
3,6a-Dimethyl-9-(2-methylbutyryl)-9,9a-dihydro-6H-furo[2,3-h]-2-benzopyran-6,8(6aH)-dione
1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(3,4-methylenedioxyphenyl)-propane|2,4-Di-Me,3,4-methylene ether-1-(3,4-Dihydroxyphenyl)-3-(2,4,6-trihydroxyphenyl)propane
(E)-6-[5-(3-furyl)-2-methylpent-2-enyl]-2,3-dimethoxy-1,4-benzoquinone|Arnebifuranone|isoarnebifuranone
3,6,8-Trimethoxy-5-isopropyl-7-methyl-2H-naphtho[1,8-bc]furan-2-one
(+/-)-2,3,4,5-Tetrahydro-6,7-dimethoxy-2,3,3,9-tetramethylnaphtho<1,2-b>furan-4,5-dione <(+/-)-8-Methoxytrypethelone Methyl Ether>|7-Me ether,8-methoxy-Trypethelone|8-Methoxytrypethelon-methylether
Laurycolactone B
Laurycolactone B is a natural product found in Eurycoma longifolia with data available.
(+/-)-7-methoxy-8-hydroxyethyl-2,4-dihydroxyflavane
4,4-(Tetrahydrofuran-3,4-diyl)bis(2-methoxyphenol)
2,4-dihydroxy-5-methyl-4,6-dimethoxydihydrochalcone
1-(2,4-dihydroxy-3,5-dimethylphenyl)-3-(2-hydroxy-4,5-methylenedioxyphenyl)-propane|1-(2,4-dihydroxy-3,5-dimethylphenyl)-3-(2-hydroxy-4,5-methylenedioxyphenyl)-propane|4,5-Methylene ether-1-(2,4-Dihydroxy-3,5-dimethylphenyl)-3-(2,4,5-trihydroxyphenyl)propane
dapdiamide E
A member of the family of dapdiamides consisting of 3-aminoalanylvaline, in which the N-terminus is acylated by a 3-carbamoyloxirane-2-carbonyl group. NB Although the relative configuration of the epoxide moiety has been assigned as trans, it has not yet been established whether the absolute configuration is R,R (as drawn) or S,S.
pterolinus C
A member of the class of 1-benzofurans that is 2,3-dihydro-1-benzofuran substituted by methoxy groups at positions 5 and 6, a methyl group at position 3 and a 3-hydroxy-4-methoxyphenyl group at position 2. It is isolated from Pterocarpus santalinus.
2,4-Dihydroxy-3,6-dimethylbenzoic acid 3-hydroxy-2,4,5-trimethylphenyl ester
2,3,3-trimethoxy-4,5-methylenedioxybibenzyl|cirrhopetalidin dimethylether|gastrochilinin
6-Acetyl-3beta-(angeloyloxy)-2,3-dihydro-2-isopropenyl-5-benzofuranol
(2S)-4-hydroxy-6,7,3-trimethoxyflavan|griffinoid A
(10S)-6,11,12-trihydroxy-15,16-dinorpimara-5,8,11,13-tetraene-3,7-dione|11-hydroxygossweilone|6,11,12-trihydroxy-15,16-dinor-ent-pimara-5,8,11,13-tetraene-3,7-dione|dryperrein B
3beta-Chloro,Me ester-(5alpha,6alpha,8alpha,9beta,10beta)-5,6-Epoxy-8-hydroxy-11-drimanoic acid
minumicrolin acetonide|threo-murrangatin acetonide
4,7-Di-Me ether-3-(4-Hydroxybenzyl)-3,4,7-chromantriol
<2-(5-Acetyl-2,3-dihydro-6-hydroxy-2-benzofuranyl)-2-propenyl>angelat|[2-(5-Acetyl-2,3-dihydro-6-hydroxy-2-benzofuranyl)-2-propenyl]angelat
2,3-dihydro-trans-2-(2-hydroxyisopropenyl) 3-angelyloxy-6-acetylbenzofuran
(2R)-2r-(3,4-Dimethoxy-phenyl)-7-methoxy-chroman-3t-ol|3.4.7-Trimethoxy-2.3-trans-flavan-3-ol|Tri-O-methyl-(-)-fisetinidol|tri-O-methylfisetinidol
3-(3,4-Dihydroxy-phenaethyl)-5,6,7,8-tetrahydro-naphthalin-1,2,4-triol|3-(3,4-dihydroxy-phenethyl)-5,6,7,8-tetrahydro-naphthalene-1,2,4-triol
4_Methoxy-9,10-Dihydro-7-hydroxy-2,4,6-trimethoxyphenanthrene
4-Methoxy-5-(3-methyl-2-butenyl)-6-(4-hydroxyphenyl)pyrogallol
[2-hydroxy-1-(4-methoxyphenyl)propyl] 4-methoxybenzoate
[1-hydroxy-1-(4-methoxyphenyl)propan-2-yl] 4-methoxybenzoate
(E)-1-(1,3,6,8-tetramethoxynaphthalen-2-yl)but-2-en-1-one
[1-hydroxy-1-(4-methoxyphenyl)propan-2-yl] 4-methoxybenzoate
[1-hydroxy-1-(4-methoxyphenyl)propan-2-yl] 4-methoxybenzoate [IIN-based on: CCMSLIB00000846469]
[1-hydroxy-1-(4-methoxyphenyl)propan-2-yl] 4-methoxybenzoate [IIN-based: Match]
[1-hydroxy-1-(4-methoxyphenyl)propan-2-yl] 4-methoxybenzoate_major
Gly Gly Pro Ser
Gly Gly Ser Pro
Gly Pro Gly Ser
Gly Pro Ser Gly
Gly Ser Gly Pro
Gly Ser Pro Gly
Pro Gly Gly Ser
Pro Gly Ser Gly
Pro Ser Gly Gly
Ser Gly Gly Pro
Ser Gly Pro Gly
Ser Pro Gly Gly
Combrestatin A4
Combretastatin A4 is a microtubule-targeting agent that binds β-tubulin with Kd of 0.4 μM.
5'-Hydroxy-3',4',7-trimethoxyflavan
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].
1-BOC-3-(3-TRIFLUOROMETHYL-PHENYLAMINO)-AZETIDINE
C15H19F3N2O2 (316.13985499999995)
1-BOC-3-(4-TRIFLUOROMETHYL-PHENYLAMINO)-AZETIDINE
C15H19F3N2O2 (316.13985499999995)
Boc-trans-DL-b-Pro-4-(3-cyanophenyl)-OH
C17H20N2O4 (316.14230000000003)
2-(3,5-dimethoxyphenyl)propan-2-yl phenyl carbonate
ETHYL 7-(ALLYLOXY)-4-OXO-8-PROPYL-4H-CHROMENE-2-CARBOXYLATE
Boc-L-1,2,3,4-Tetrahydronorharman-3-carboxylic acid
C17H20N2O4 (316.14230000000003)
boc-d-1,2,3,4-tetrahydronorharman-3-carboxylic acid
C17H20N2O4 (316.14230000000003)
5-(3-(BENZYLOXY)PHENYL)-7H-PYRROLO[2,3-D]PYRIMIDIN-4-AMINE
sodium 1-methyl 2-sulphonatododecanoate
C13H25NaO5S (316.13203200000004)
5-(3-(benzyloxy)phenyl)-3H-pyrrolo[2,3-d]pyrimidin-4-amine
2-Boc-1,3,4,5-Tetrahydro-pyrido[4,3-b]indole-8-carboxylic acid
C17H20N2O4 (316.14230000000003)
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-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-tert-butylbenzamide
N-[3-(4-morpholinyl)propyl]-2-oxo-1-benzopyran-3-carboxamide
C17H20N2O4 (316.14230000000003)
1-(3-methylphenyl)-N-(2-pyridinylmethyl)-4-pyrazolo[3,4-d]pyrimidinamine
2-[(3-Methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-1-yl)oxy]propanoic acid methyl ester
2-(3-methoxyphenyl)-N-pyridin-3-yl-1H-pyrrolo[3,2-c]pyridin-4-amine
Nbeta-(R,R)-epoxysuccinamoyl-(S)-2,3-diaminopropanoyl-L-valine
(2S)-2-[[(2S)-3-amino-2-[(3-carbamoyloxirane-2-carbonyl)amino]propanoyl]amino]-3-methylbutanoic acid
(2S)-2-[[(2S)-2-amino-3-[[(2R,3R)-3-carbamoyloxirane-2-carbonyl]amino]propanoyl]amino]-3-methylbutanoic acid
(E)-1-(1,3,6,8-tetramethoxynaphthalen-2-yl)but-2-en-1-one
Chermesinone B
An azaphilone that is 9,9a-dihydro-6H-furo[2,3-h]isochromene-6,8(6aH)-dione substituted by methyl groups at positions 3 and 6a and a 2-methylbutanoyl group at position 9. It has been isolated from the culture of the mangrove endophytic fungus Penicillium chermesinum.
1-[(2-Methylpropylamino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one
C17H20N2O4 (316.14230000000003)
2-[(2-Ethyl-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-3-yl)oxy]acetic acid methyl ester
4-[(2,4-Dioxo-1,3-diazaspiro[4.5]decan-3-yl)methyl]benzoic acid methyl ester
C17H20N2O4 (316.14230000000003)
2-oxo-1H-pyridine-3-carboxylic acid [2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethyl] ester
C17H20N2O4 (316.14230000000003)
4-[3-(3-Methylanilino)-2-imidazo[1,2-a]pyrimidinyl]phenol
2-[(3-Methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-2-yl)oxy]acetic acid ethyl ester
3-[[[(2R*,3R*)-3-carboxyoxiran-2-yl]carbonyl]amino]-L-alanyl-L-valine
1-(2,4-Dihydroxy-6-methoxy-3,5-dimethylphenyl)-3-(2-hydroxyphenyl)propan-1-one
[(3aS,4R,9S,10aS)-2,6-diamino-9,10,10-trihydroxy-1,3a,4,5,8,9-hexahydropyrrolo[1,2-c]purin-7-ium-4-yl]methyl carbamate
4-(N-(N,N-Dimethylcarbamoyl)amino)phenoxymethyl 3-methylphenyl sulfide
dapdiamide E zwitterion
A peptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of dapdiamide C; major species at pH 7.3. NB Although the relative configuration of the epoxide moiety has been assigned as trans, it has not yet been established whether the absolute configuration is R,R (as drawn) or S,S.
3-(2-hydroxy-3,4,6-trimethoxyphenyl)-1-phenylpropan-1-one
(2e)-n-{1-[(2e)-3-(methylsulfanyl)prop-2-enoyl]pyrrolidin-2-yl}-3-phenylprop-2-enimidic acid
2,3-dimethoxy-6-(7-methoxy-3,4-dihydro-2h-1-benzopyran-3-yl)phenol
5-[(1e)-2-(3,4-dimethoxyphenyl)ethenyl]-2,3-dimethoxyphenol
5-acetyl-6-hydroxy-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-3-yl 2-methylbut-2-enoate
(4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate
C17H20N2O4 (316.14230000000003)
4-[5-(3,4-dihydroxyphenyl)-3,4-dimethyloxolan-2-yl]benzene-1,2-diol
2-[5-(2h-1,3-benzodioxol-5-yl)pentanoyl]-3-hydroxycyclohex-2-en-1-one
(2e)-3-(methylsulfanyl)-n-[(2r)-1-[(2e)-3-phenylprop-2-enoyl]pyrrolidin-2-yl]prop-2-enimidic acid
(3s,5e,11e)-14,16-dihydroxy-3-methyl-4,7,9,10-tetrahydro-3h-2-benzoxacyclotetradecine-1,8-dione
(3r,5e,7r,9e)-7,16-dihydroxy-3-methyl-4,7,8,12-tetrahydro-3h-2-benzoxacyclotetradecine-1,11-dione
(2r,3s)-5-acetyl-2-(3-hydroxyprop-1-en-2-yl)-2,3-dihydro-1-benzofuran-3-yl (2z)-2-methylbut-2-enoate
2-[(8s)-2-oxo-8h,9h-furo[2,3-h]chromen-8-yl]propan-2-yl 2-methylpropanoate
(2r,3r)-5-acetyl-2-(3-hydroxyprop-1-en-2-yl)-2,3-dihydro-1-benzofuran-3-yl (2z)-2-methylbut-2-enoate
(2r)-1-(2,4-dimethoxyphenyl)-2-hydroxy-3-(4-methoxyphenyl)propan-1-one
11-hydroxy-2,6,9,15-tetramethyl-13-oxatetracyclo[10.2.1.0²,¹⁰.0⁵,⁹]pentadeca-4,6-diene-3,8,14-trione
1-[5-(2,5-dihydroxyphenyl)furan-3-yl]-4-methylpent-3-en-1-yl acetate
5,6,7-trimethoxy-2-phenyl-3,4-dihydro-2h-1-benzopyran-4-ol
(2s,3r)-6-acetyl-5-hydroxy-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-3-yl (2z)-2-methylbut-2-enoate
(1r,2s)-1-[4',6-dihydroxy-3'-(prop-2-en-1-yl)-[1,1'-biphenyl]-3-yl]propane-1,2,3-triol
3-(6-hydroxy-2,3,4-trimethoxyphenyl)-1-phenylpropan-1-one
4-[3-(6-hydroxy-2h-1,3-benzodioxol-5-yl)propyl]-2,6-dimethylbenzene-1,3-diol
3-[3-(4-hydroxy-3-methoxyphenyl)prop-1-en-1-yl]-2,6-dimethoxyphenol
(2s)-2-{[(2s)-3-amino-1-hydroxy-2-({hydroxy[3-(c-hydroxycarbonimidoyl)oxiran-2-yl]methylidene}amino)propylidene]amino}-3-methylbutanoic acid
4-[(2e)-3-(3-hydroxy-2-methoxyphenyl)prop-2-en-1-yl]-2,3-dimethoxyphenol
(2r,3s)-5-acetyl-6-hydroxy-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-3-yl (2z)-2-methylbut-2-enoate
2'-methoxymollugin
{"Ingredient_id": "HBIN005918","Ingredient_name": "2'-methoxymollugin","Alias": "NA","Ingredient_formula": "C18H20O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14033","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5-[(E)-5-(3-furyl)-2-methyl-pent-2-enyl]-2,3-dimethoxy-p-benzoquinone
{"Ingredient_id": "HBIN011520","Ingredient_name": "5-[(E)-5-(3-furyl)-2-methyl-pent-2-enyl]-2,3-dimethoxy-p-benzoquinone","Alias": "5-[(E)-5-furan-3-yl-2-methyl-pent-2-enyl]-2,3-dimethoxy-cyclohexa-2,5-diene-1,4-dione; 5-[(E)-5-(3-furyl)-2-methyl-pent-2-enyl]-2,3-dimethoxy-1,4-benzoquinone; 5-[(E)-5-furan-3-yl-2-methylpent-2-enyl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione; 5-[(E)-5-(3-furyl)-2-methylpent-2-enyl]-2,3-dimethoxy-1,4-benzoquinone","Ingredient_formula": "C18H20O5","Ingredient_Smile": "NA","Ingredient_weight": "316.35","OB_score": "61.79737106","CAS_id": "94805-71-7","SymMap_id": "SMIT09113","TCMID_id": "NA","TCMSP_id": "MOL007734","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7-O-methylisomucronulatol
{"Ingredient_id": "HBIN013410","Ingredient_name": "7-O-methylisomucronulatol","Alias": "7-o-methylisomucronulatol; 7-o-methyl isomucronulatol","Ingredient_formula": "C18H20O5","Ingredient_Smile": "COC1=CC2=C(CC(CO2)C3=C(C(=C(C=C3)OC)OC)O)C=C1","Ingredient_weight": "316.3 g/mol","OB_score": "74.68613752","CAS_id": "NA","SymMap_id": "SMIT02992","TCMID_id": "14525","TCMSP_id": "MOL000378","TCM_ID_id": "7426","PubChem_id": "15689652","DrugBank_id": "NA"}
arctignan h
{"Ingredient_id": "HBIN016619","Ingredient_name": "arctignan h","Alias": "NA","Ingredient_formula": "C18H20O5","Ingredient_Smile": "COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)CC4C(COC4=O)CC5=CC(=C(C=C5)OC(CO)C(C6=CC(=C(C=C6)O)OC)O)OC","Ingredient_weight": "316.35","OB_score": "NA","CAS_id": "94805-71-7","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6699","PubChem_id": "10771248","DrugBank_id": "NA"}
arnebifuranone
{"Ingredient_id": "HBIN016861","Ingredient_name": "arnebifuranone","Alias": "AC1O6QVB; Isoarnebifuranone; 5-[(E)-5-(furan-3-yl)-2-methylpent-2-enyl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione","Ingredient_formula": "C18H20O5","Ingredient_Smile": "CC(=CCCC1=COC=C1)CC2=CC(=O)C(=C(C2=O)OC)OC","Ingredient_weight": "316.3 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14384","TCMID_id": "1744","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "6438590","DrugBank_id": "NA"}
4-[(2e)-3-(2-hydroxy-5-methoxyphenyl)prop-2-en-1-yl]-2,3-dimethoxyphenol
5-methoxy-6-(3-methylbut-2-en-1-yl)-[1,1'-biphenyl]-2,3,4,4'-tetrol
1-[4',6-dihydroxy-3'-(prop-2-en-1-yl)-[1,1'-biphenyl]-3-yl]propane-1,2,3-triol
4-(5,7-dimethoxy-3,4-dihydro-2h-1-benzopyran-2-yl)-2-methoxyphenol
3-[(1e)-3-(4-hydroxy-3-methoxyphenyl)prop-1-en-1-yl]-2,6-dimethoxyphenol
4-[3-(6-methoxy-2h-1,3-benzodioxol-5-yl)propyl]-2-methylbenzene-1,3-diol
{7-hydroxy-2-[(2e,4s)-4-methylhex-2-en-2-yl]-4-oxochromen-5-yl}acetic acid
(2e)-3-(methylsulfanyl)-n-[(2s)-1-[(2e)-3-phenylprop-2-enoyl]pyrrolidin-2-yl]prop-2-enimidic acid
2-(5-acetyl-6-hydroxy-2,3-dihydro-1-benzofuran-2-yl)prop-2-en-1-yl 2-methylbut-2-enoate
(2r,3r)-5-acetyl-6-hydroxy-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-3-yl (2e)-2-methylbut-2-enoate
4-[(2s)-5,7-dimethoxy-3,4-dihydro-2h-1-benzopyran-2-yl]-2-methoxyphenol
(1s)-1-[6-methoxy-3-oxo-2-(propan-2-ylidene)-1-benzofuran-5-yl]ethyl 2-methylprop-2-enoate
(2r,3r)-2-(4-hydroxyphenyl)-5,7-dimethoxy-8-methyl-3,4-dihydro-2h-1-benzopyran-3-ol
3-hydroxy-2,4,5-trimethylphenyl 2,4-dihydroxy-3,6-dimethylbenzoate
(1s)-1-[5-(2,5-dihydroxyphenyl)furan-3-yl]-4-methylpent-3-en-1-yl acetate
5-[3-(2-hydroxyphenyl)prop-2-en-1-yl]-2,3,4-trimethoxyphenol
n,n'-bis[(4-methoxyphenyl)methyl]carbamimidothioic acid
5-[(1z)-2-(3,4-dimethoxyphenyl)ethenyl]-2,3-dimethoxyphenol
(2s,4r)-5,6,7-trimethoxy-2-phenyl-3,4-dihydro-2h-1-benzopyran-4-ol
n-{1-[3-(methylsulfanyl)prop-2-enoyl]pyrrolidin-2-yl}-3-phenylprop-2-enimidic acid
2-[3-(2h-1,3-benzodioxol-5-yl)propyl]-3,5-dimethoxyphenol
14,16-dihydroxy-3-methyl-4,7,8,12-tetrahydro-3h-2-benzoxacyclotetradecine-1,11-dione
(6ar,9r,9ar)-3,6a-dimethyl-9-[(2s)-2-methylbutanoyl]-9h,9ah-furo[2,3-h]isochromene-6,8-dione
8-(dimethylamino)-3,10,19-triazapentacyclo[10.7.1.0²,⁷.0⁹,²⁰.0¹³,¹⁸]icosa-1(19),2,7,9(20),11,13(18),14,16-octaen-6-one
4-chloro-2-(2-hydroxypropan-2-yl)-6-(3-methylbut-2-en-1-ylidene)-hexahydro-1-benzofuran-3a,5-diol
(2e)-n-[(2r)-1-[(2e)-3-(methylsulfanyl)prop-2-enoyl]pyrrolidin-2-yl]-3-phenylprop-2-enimidic acid
(3s,5z,9e)-14,16-dihydroxy-3-methyl-4,7,8,12-tetrahydro-3h-2-benzoxacyclotetradecine-1,11-dione
5-[(1s)-1-(4-hydroxyphenyl)prop-2-en-1-yl]-2,3,4-trimethoxyphenol
4-hydroxy-5-[(4-hydroxy-2-methoxy-3,6-dimethylphenyl)methyl]-3,6-dimethylcyclohexa-3,5-diene-1,2-dione
(1s,2r,9r,10s,11r,12r,15r)-11-hydroxy-2,6,9,15-tetramethyl-13-oxatetracyclo[10.2.1.0²,¹⁰.0⁵,⁹]pentadeca-4,6-diene-3,8,14-trione
5-[(2e)-5-(furan-3-yl)-2-methylpent-2-en-1-yl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione
1-(6-hydroxy-2,4-dimethoxy-3-methylphenyl)-3-(4-hydroxyphenyl)propan-1-one
5-[5-(furan-3-yl)-2-methylpent-2-en-1-yl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione
7-isopropyl-5,9,11-trimethoxy-10-methyl-2-oxatricyclo[6.3.1.0⁴,¹²]dodeca-1(12),4,6,8,10-pentaen-3-one
5-acetyl-6-hydroxy-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-3-yl 3-methylbut-2-enoate
2,3-dimethoxy-6-[(3r)-7-methoxy-3,4-dihydro-2h-1-benzopyran-3-yl]phenol
4-[3-(3-hydroxy-2-methoxyphenyl)prop-2-en-1-yl]-2,3-dimethoxyphenol
4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate
C17H20N2O4 (316.14230000000003)