Exact Mass: 362.1186
Exact Mass Matches: 362.1186
Found 500 metabolites which its exact mass value is equals to given mass value 362.1186
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Chelirubine
A benzophenanthridine alkaloid that is sanguinarine bearing a methoxy substituent at position 10.
Catalpol
Catalpol is an organic molecular entity. It has a role as a metabolite. Catalpol is a natural product found in Verbascum lychnitis, Plantago atrata, and other organisms with data available. See also: Rehmannia glutinosa Root (part of). Catalpol (Catalpinoside), an iridoid glycoside found in Rehmannia glutinosa. Catalpol has neuroprotective, hypoglycemic, anti-inflammatory, anti-cancer, anti-spasmodic, anti-oxidant effects and anti-HBV effects[1][2][3]. Catalpol (Catalpinoside), an iridoid glycoside found in Rehmannia glutinosa. Catalpol has neuroprotective, hypoglycemic, anti-inflammatory, anti-cancer, anti-spasmodic, anti-oxidant effects and anti-HBV effects[1][2][3].
Nagilactone C
Nagilactone is a natural product found in Podocarpus hallii, Afrocarpus gracilior
gibberellin A8-catabolite
A tetracyclic diterpenoid obtained by catabolism of gibberellin A8.
AZD7762
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor
Gibberellin A21
Gibberellin A21 (GA21) belongs to the class of organic compounds known as C19-gibberellin 6-carboxylic acids. These are C19-gibberellins with a carboxyl group at the 6-position. Gibberellin A21 is found in pulses. Gibberellin A21 is a constituent of the immature seeds of Canavalia gladiata (sword bean). Constituent of the immature seeds of Canavalia gladiata (sword bean). Gibberellin A21 is found in pulses.
Zanthobisquinolone
Zanthobisquinolone is found in fruits. Zanthobisquinolone is an alkaloid from root wood of Zanthoxylum simulans (Szechuan pepper). Alkaloid from root wood of Zanthoxylum simulans (Szechuan pepper). Zanthobisquinolone is found in herbs and spices and fruits.
Gibberellin A87
Gibberellin A87 (GA87) belongs to the class of organic compounds known as C19-gibberellin 6-carboxylic acids. These are C19-gibberellins with a carboxyl group at the 6-position. Gibberellin A87 is found in fruits. Gibberellin A87 is a constituent of Prunus avium (wild cherry). Constituent of Prunus avium (wild cherry). Gibberellin A87 is found in many foods, some of which are sour cherry, peach, sweet cherry, and fruits.
Diosbulbin C
Diosbulbin C is found in root vegetables. Diosbulbin C is a constituent of Dioscorea bulbifera (air potato). Constituent of Dioscorea bulbifera (air potato). Diosbulbin C is found in root vegetables.
Gibberellin A93
Gibberellin A93 (GA93) belongs to the class of organic compounds known as C19-gibberellin 6-carboxylic acids. These are C19-gibberellins with a carboxyl group at the 6-position. Gibberellin A93 is found in cereals and cereal products. Gibberellin A93 is a constituent of Triticum aestivum (wheat). Constituent of Triticum aestivum (wheat). Gibberellin A93 is found in wheat, cereals and cereal products, and common wheat.
2',8-Dihydroxy-3',4',5',7-tetramethoxyflavan
2,8-Dihydroxy-3,4,5,7-tetramethoxyflavan is found in fruits. 2,8-Dihydroxy-3,4,5,7-tetramethoxyflavan is a constituent of the roots of Muntingia calabura (Jamaica cherry). Constituent of the roots of Muntingia calabura (Jamaica cherry). 2,8-Dihydroxy-3,4,5,7-tetramethoxyflavan is found in fruits.
(2R,3S,4R,5R,6S)-2-[[(1R,2R,4R,5R,6S,10R)-5-Hydroxy-2-(hydroxymethyl)-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-10-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
3-(5-Methylisoxazol-3-yl)-6-[(1-methyl-1H-1,2,3-triazol-4-yl)methoxy][1,2,4]triazolo[3,4-a]phthalazine
α5IA (L-822179) is a selective α5 GABAA receptor inverse agonist with neuroprotective potential[1].
5Z-7-Oxozeaenol
homocamptothecin
2-Chloro-N-[[4-[(2-chloroanilino)methyl]cyclohexyl]methyl]aniline
Ligstroside-aglycone
Ligstroside-aglycone belongs to iridoids and derivatives class of compounds. Those are monoterpenes containing a skeleton structurally characterized by the presence of a cylopentane fused to a pyran ( forming a 4,7-dimethylcyclopenta[c]pyran), or a derivative where the pentane moiety is open. Ligstroside-aglycone is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Ligstroside-aglycone can be found in olive, which makes ligstroside-aglycone a potential biomarker for the consumption of this food product.
gibberellin A8-catabolite
Gibberellin a8-catabolite is a member of the class of compounds known as c19-gibberellin 6-carboxylic acids. C19-gibberellin 6-carboxylic acids are c19-gibberellins with a carboxyl group at the 6-position. Gibberellin a8-catabolite is slightly soluble (in water) and a weakly acidic compound (based on its pKa). Gibberellin a8-catabolite can be found in a number of food items such as chia, durian, pepper (c. annuum), and mung bean, which makes gibberellin a8-catabolite a potential biomarker for the consumption of these food products.
Danmelittoside
Monomelittoside is a natural product found in Plantago media, Stachys lavandulifolia, and other organisms with data available.
[3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha,7abeta]]-5-(1-Formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid
Samaderine B
A quassinoid isolated from Quassia indica and Samadera madagascariensis. It exhibits antimalarial and cytotoxic activities.
[3aS-(3aalpha,4alpha,4abeta,6alpha,9alpha,9aalpha,10beta,10aalpha)]-Dodecahydro-10-hydroxy-9a-methyl-3,5-bis(methylene)-2-oxo-6,9-epoxyfuro[2,3-h][3]benzoxepin-4-yl ester 2-methyl-2-propenoic acid
[3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha,7abeta]]-5-(1-Formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-7-benzofuranyl ester 2-methyl-2-propenoic acid
Chamanetin
Oxoafraglaucolide
[3aS-(3aR*,4R*,5R*,6S*,10R*,11aS*)]-2,3,3a,4,5,6,7,10,11,11a-Decahydro-5-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca[b]furan-4-yl ester 2-methyl-2-propenoic acid
2,3,3a,4,5,6,7,8,9,11a-Decahydro-9-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca[b]furan-4-yl ester 2-methyl-2-propenoic acid
2,7-Dihydroxy-1-(4-hydroxybenzoyl)4-methoxy-9,10-dihydrophenanthrene
[3aS-(3aalpha,4alpha,5alpha,9alpha,9aalpha,9bbeta)]-4,5-Bis(acetyloxy)-3a,4,5,9,9a,9b-hexahydro-9-hydroxy-6,9-dimethyl-3-methylene-azuleno[4,5-b]furan-2(3H)-one
[3aS-(3aalpha,4alpha,5alpha,9beta,9aalpha,9bbeta)]-4,5-Bis(acetyloxy)-3a,4,5,9,9a,9b-hexahydro-9-hydroxy-6,9-dimethyl-3-methylene-azuleno[4,5-b]furan-2(3H)-one
Isochamanetin
A natural product found in Piper sarmentosum.
alpha-Aminoorcein
A member of the class of phenoxazines that is 1,9-dimethyl-3H-phenoxazin-3-one carrying additional amino and 2,4-dihydroxy-6-methylphenyl substituents at positions 7 and 8 respectively. A component of orcein, a mixture of dyes isolated from lichens.
[(3aS,4S,5S,6E,10Z,11aR)-6-formyl-5-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate
6-O-trans-p-coumaroyl-3beta-O-methyl-7-deoxyrehmaglutin A|6-O-trans-p-Coumaroyl-3??-O-methyl-7-deoxyrehmaglutin A
(E)-8alpha,15-Diacetoxy-1-oxo-beta-cyclocostunolid|1-Ketone,8,15-di-Ac-1,8,15-Trihydroxy-4(15),11(13)-eudesmadien-12,6-olide
8-(Methylpropanoyl)-(4Z,6alpha,8beta,9alpha,10beta)-3,10-Epoxy-8,9-dihydroxy-1-oxo-2,4,11(13)-germacratrien-12,6-olide
2-Ketone,8,15-di-Ac-1,8,15-Trihydroxy-4,10(14),11(13)-germacratrien-12,6-olide
(6S,7R,8S)-8,14-diacetoxyhelianga-1(10),4,11(13)-trien-15-al-6,12-olide
[3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha,7abeta]]-5-(1-Formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid
(4R*,5S*,6S*,7R*,8S*,10R*)-8-(2,3-Epoxy-2-methylpropanoyloxy)-4-hydroxy-1-oxoeudesma-2,7(11)-dien-6,12-olide
3,4,7,8-Tetra-Me ether-(2R,3S,4S)-3,3,4,4,7,8-Hexahydroxyflavan
(3,4,5-triacetyloxy-6-methoxyoxan-2-yl)methyl acetate
(+)-Halenaquinol dimethyl ether|(12bS)-(+)-8,11-dimethoxy-12b-methyl-1H-benzo[6,7]phenanthro(10,1-bc)furan-3,6(2H,12b H)-dione|halenaquinol dimethyl ether
2,2-dihydroxy-4,4,6,6-tetramethoxy-3,3-dimethylbenzophenone
(5R,6R,7R,8S,10S)-8,14-diacetoxyelema-1,3,11(13)-trien-15-al-6,12-olide
2-O-beta-D-glucosyltrideca-3E,11Z-dien-5,7,9-triyn-1,2-diol
2-caffeoyloxy-3-hydroxy-3-(3,4-dihydroxyphenyl)propyl alcohol
2-(3,4-Dimethoxyphenyl)-7,8-dimethoxy-3,4-chromanediol #
(2aS,3R,4aS,6R,11aR,11bR)-3-hydroxy-10-(hydroxymethyl)-3-isopropenyl-2a,6,10-trimethyl-2a,3,5,6,11a,11b-hexahydro-2H-6,9-epoxy-1,4-dioxacyclodeca[cd]pentalene-2,7(4aH)-dione|(2aS,3R,4aS,6R,11aR,11bR)-3-hydroxy-10-(hydroxymethyl)-3-isopropenyl-2a,6-dimethyl-2a,3,5,6,11a,11b-hexahydro-2H-6,9-epoxy-1,4-dioxacyclodeca[cd]pentalene-2,7(4aH)-dione|15-hydroxy-remantholide C|15-hydroxyeremantholide C
3-(3-Hydroxy-4-methoxybenzyl)-3,5,6-trihydroxy-7-methoxychroman-4-one
1-(p-hydroxybenzoyl)-2-methoxy-4,7-dihydroxy-9,10-dihydrophenanthrene
inumakilactone
A diterpene lactone isolated from Podocarpus latifolius and has been shown to exhibit inhibitory activity against activator protein 1 (AP-1).
5-(hydroxymethyl)-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]-oxy}-4,5,6,8-tetrahydro-1H,3H-pyrano[3,4-c]-pyran-1-one|enicostemin B
1alpha,8alpha-diacetoxy-2-oxo-eudesman-3,7(11)-dien-8,12-olide
2-Deoxy-D-araabino-hexonic acid,9CI,8CI-Me ester, tetra-Ac
2-beta-D-glucopyranosyloxy-1-hydroxytrideca-5,7,9,11-tetrayne|2beta-D-glucopyranosyloxy-1-hydroxytrideca-5,7,9,11-tetrayne|Cytopiloyne
4-Hydroxy-5-(3-methylbutyryl)-9-phenyl-1,6-dioxa-7H-benzo[e]indene-7-one
(7R)-7-hydroxytaxiresinol
A lignan that consists of tetrahydrofuran substituted by a 3,4-dihydroxyphenyl group at position 2, a hydroxymethyl group at position 3 and a hydroxy(4-hydroxy-3-methoxyphenyl)methyl group at position 4. It has been isolated from Taxus yunnanensis. D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors > D065692 - Cytochrome P-450 CYP3A Inhibitors
(1S*,4R*,7S*,8S*,10R*)-1-hydroxy-1,4,7,10-diepoxy-8-methacryloxygermacra-5Z,11(13)-dien-6,12-olide
4beta-hydroxy-4,5-dihydro-5,6-dehydrovernonallenolide
O1-(4-phenoxy-phenyl)-beta-D-glucopyranuronic acid|O1-(4-Phenoxy-phenyl)-beta-D-glucopyranuronsaeure
(6S,7R,8S)-8,15-diacetoxy-14-oxomelampa-1(10),4,11(13)-trien-12,6-olide|(6S,7R,8S)-8,15-diacetoxymelampa-1(10),4,11(13)-trien-14-al-6,12-olide|(E,E)-8alpha,15-Diacetoxy-14-oxo-1(10),4,11(13)-germacratrien-12,6-olid
8alpha,13-diacetoxy-7,11-dehydro-11,13-dihydroanhydroverlotorin
5-hydroxy-6,8-dimethoxy-2-benzyl-4h-naphtho[2,3-b]-pyran-4-one
2,3,3a,4,5,6,7,8,9,11a-Decahydro-9-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca[b]furan-4-yl ester 2-methyl-2-propenoic acid
ACon1_001022
7-amino-8-(2,4-dihydroxy-6-methylphenyl)-1,9-dimethyl-3H-phenoxazin-3-one
relative retention time with respect to 9-anthracene Carboxylic Acid is 1.101 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.098 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.096 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.092
3,8-dihydroxy-1-methoxy-4-(1,3,4-trihydroxybutan-2-yl)xanthen-9-one
methyl 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate
methyl 2-hydroxy-6-(2-hydroxy-4-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate
C19H22O7_(3aS,4S,5S,6E,10Z,11aR)-6-Formyl-5-hydroxy-10-(hydroxymethyl)-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl methacrylate
methyl 2-hydroxy-6-(2-hydroxy-4-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate [IIN-based: Match]
methyl 2-hydroxy-6-(2-hydroxy-4-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate [IIN-based on: CCMSLIB00000848992]
8-2-Amino-3,8-dimmethylimidazo[4,5-f]quinoxaline-guanine
[(3aS,4S,5S,6E,10Z,11aR)-6-formyl-5-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate_major
Cys Gly Pro Ser
Cys Gly Ser Pro
Cys Pro Gly Ser
Cys Pro Ser Gly
Cys Ser Gly Pro
Cys Ser Pro Gly
Asp Asp Gly Gly
Asp Gly Asp Gly
Asp Gly Gly Asp
Gly Cys Pro Ser
Gly Cys Ser Pro
Gly Asp Asp Gly
Gly Asp Gly Asp
Gly Gly Asp Asp
Gly Pro Cys Ser
Gly Pro Ser Cys
Gly Ser Cys Pro
Gly Ser Pro Cys
Pro Cys Gly Ser
Pro Cys Ser Gly
Pro Gly Cys Ser
Pro Gly Ser Cys
Pro Ser Cys Gly
Pro Ser Gly Cys
Ser Cys Gly Pro
Ser Cys Pro Gly
Ser Gly Cys Pro
Ser Gly Pro Cys
Ser Pro Cys Gly
Ser Pro Gly Cys
Gibberellin A93
2',8-Dihydroxy-3',4',5',7-tetramethoxyflavan
Gibberellin A21
Diosbulbin C
Gibberellin A87
Zanthobisquinolone
3,3,4,4,5,5,6,6,6-nonafluorohexyl-di(propan-2-yl)silane
3,4,6-Tri-O-acetyl-a-D-glucopyranose 1,2-(methyl orthoacetate)
5-CHLORO-1,3-DIHYDRO-1,3,3-TRIMETHYLSPIRO[2 H-INDOLE-2,3-[3 H]NAPHTH[2,1-B][1,4]OXAZINE]
2,2-DIMETHYL-5-[(4-MORPHOLINO-3-NITROPHENYL)METHYLENE]-1,3-DIOXANE-4,6-DIONE
ethyl 1,6-dimethyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-1-ium-3-carboxylate,methyl sulfate
3,4,6-Tri-O-acetyl-α-D-galactopyranose 1,2-(methyl orthoacetate)
METHYL 6-(4-(((BENZYLOXY)CARBONYL)AMINO)PHENYL)PICOLINATE
N-(5-(5-FLUORO-6-METHYLPYRIDIN-2-YL)-4-(QUINOXALIN-6-YL)-1H-IMIDAZOL-2-YL)ACETAMIDE
1,5-Benzothiazepin-4(5H)-one,5-[2-(dimethylamino)ethyl]-2,3-dihydro-2-phenyl-, hydrochloride (1:1)
2,3-BIS(3-METHYLPHENYL)-5-PHENYLTETRAZOLIUM CHLORIDE
2-phenoxyethoxycarbonyloxy 2-phenoxyethyl carbonate
Methyl 7-methoxy-2,2-diphenyl-1,3-benzodioxole-5-carboxylate
Methanone,1,1-[1,1-biphenyl]-2,2-diylbis[1-phenyl-
4-phenylmethoxy-3-phenylmethoxycarbonylbenzoic acid
N,N-Diethyl-2-[(2-Thienylcarbonyl)amino]-4,5,6,7-Tetrahydro-1-Benzothiophene-3-Carboxamide
N-[(1s)-2-Amino-1-Phenylethyl]-5-(1h-Pyrrolo[2,3-B]pyridin-4-Yl)thiophene-2-Carboxamide
5Z-7-Oxozeaenol
A macrolide that is the 7-oxo derivative of zeaenol (the 5Z stereoisomer). Isolated from Fungi, it exhibits cytotoxic, antibacterial and inhibitory activity against NF-kappaB.
N-carbamoyl-2-(triphenylphosphoranylidene)acetamide
5-[3,4-dihydro-1H-isoquinolin-2-yl(phenyl)methyl]-6-thiazolo[3,2-b][1,2,4]triazolol
2-Ethyl-3-[(4-methoxyphenyl)methyl][1]benzopyrano[2,3-d]pyrimidine-4,5-dione
(R)-5-(3-Fluorophenyl)-N-(piperidin-3-yl)-3-ureidothiophene-2-carboxamide
4,5-bis(4-methoxyphenyl)-2-thiophen-2-yl-1H-imidazole
(3aS,4R,9bR)-2,2-difluoro-4-(4-hydroxyphenyl)-6-(methoxymethyl)-1,2,3,3a,4,9b-hexahydrocyclopenta[c]chromen-8-ol
(3R,5Z,8S,9S,11E)-8,9,16-Trihydroxy-14-methoxy-3-methyl-3,4,9,10-tetrahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione
6-Chloro-2-(2-hydroxy-biphenyl-3-YL)-1H-indole-5-carboxamidine
[6-Formyl-5-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate
5-Hydroxy-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9,11-dicarboxylic acid
4,5,12-Trihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylic acid
5,15-Dihydroxy-11-methyl-6-methylidene-17-oxo-13,16-dioxahexacyclo[9.4.2.15,8.01,10.02,8.012,14]octadecane-9-carboxylic acid
(6E,12E)-9,10,18-trihydroxy-16-methoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),6,12,15,17-pentaene-2,8-dione
4-(6-Amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl 2-furoate
2-Furanyl-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]methanone
azanigerone A
An azaphilone that is the ester obtained by formal condensation of the carboxy group of 2,4-dimethylhexanoic acid with the tertiary hydroxy group of 7-hydroxy-7-methyl-6,8-dioxo-7,8-dihydro-6H-2-benzopyran-3-carboxylic acid.
N-[3-cyano-4,5-bis(4-methoxyphenyl)furan-2-yl]acetamide
1-(2-Methoxy-3-dibenzofuranyl)-3-(3-methylphenyl)thiourea
6-Methyl-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-quinolinecarbonitrile
Benzoic acid [3,4-dihydroxy-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methyl ester
N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-2-phenoxyacetamide
N-[4-(1H-benzimidazol-2-yl)phenyl]-2-methyl-4-nitro-3-pyrazolecarboxamide
N-[(2-methoxyphenyl)-oxomethyl]-2-(4-morpholinyl)-4-thiazolecarbohydrazide
2-(4-Methylcyclohexylidene)-2-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]acetonitrile
N,8-Dimethyl-N-(3-methylphenyl)-4-oxo-5H-thieno[3,2-C]quinoline-2-carboxamide
N-[[3-(hydroxymethyl)anilino]-sulfanylidenemethyl]-4-phenylbenzamide
Diphenyl (2R,3S)-3-hydroxy-2-methyl-1-oxopentyl methanephosphonate
2-[[(3-Methoxyanilino)-oxomethyl]-[(3-methyl-2-thiophenyl)methyl]amino]acetic acid ethyl ester
(1S,2S,4aR,4bR,7S,9S,9aR,10S,10aR)-2,7,9-trihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid
1-(2-phenylethyl)-5-[(E)-3-phenylprop-2-enoyl]-1,3-diazinane-2,4,6-trione
[(3aS,4S,5S,6E,11aR)-6-formyl-5-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate
[(6E,10Z)-6-formyl-5-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate
[(3aS,4S,5S,6E,10E,11aR)-6-formyl-5-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate
5E-7-oxozeaenol
A macrolide that is the 7-oxo derivative of zeaenol (the 5E stereoisomer). Isolated from Fungi, it exhibits cytotoxic, antibacterial and inhibitory activity against NF-kappaB.
DPBQ
DPBQ activates p53 and triggers apoptosis in a polyploid-specific manner, but does not inhibit topoisomerase or bind DNA. DPBQ elicits expression and phosphorylation of p53 and this effect is specific to tetraploid cells[1].
L-745870 (hydrochloride)
L-745870 hydrochloride is a potent, selective, brain-penetrant and orally active dopamine D4 receptor antagonist with a Ki of 0.43 nM. L-745870 hydrochloride shows weaker affinity for D2 (Ki of 960 nM) and D3 (Ki of 2300 nM) receptors, and exhibits moderate affinity for 5-HT2 receptors, sigma sites and α-adrenoceptors[1][2][3].
(1r,2r,6s,7z,11s)-8-(hydroxymethyl)-3-methylidene-4,13-dioxo-5,14-dioxatricyclo[10.2.1.0²,⁶]pentadeca-7,12(15)-dien-11-yl 2-methylpropanoate
5-(acetyloxy)-4-hydroxy-3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-8-yl acetate
(1s,3r,7z,9s,12s,13r,15r)-13-hydroxy-7-(hydroxymethyl)-3,12-dimethyl-13-(prop-1-en-2-yl)-10,14,16-trioxatetracyclo[7.5.1.1³,⁶.0¹²,¹⁵]hexadeca-5,7-diene-4,11-dione
(2s,4as,6as,7r,9r,10ar,10bs)-2-(furan-3-yl)-9-hydroxy-10b-methyl-4,6-dioxo-decahydronaphtho[2,1-c]pyran-7-carboxylic acid
5-hydroxy-6-[(2r)-2-methylbutanoyl]-4-phenylfuro[2,3-h]chromen-2-one
10-(hydroxymethyl)-6-methyl-3-methylidene-2,9-dioxo-3ah,4h,5h,8h,11ah-cyclodeca[b]furan-4-yl 2-(hydroxymethyl)prop-2-enoate
(3s,5z,8r,9r,11z)-8,9,16-trihydroxy-14-methoxy-3-methyl-4,8,9,10-tetrahydro-3h-2-benzoxacyclotetradecine-1,7-dione
(1s,4r,5s,8r,9s,10s,11r,12s,16r)-9,12-dihydroxy-4,11,15-trimethyl-3,7-dioxapentacyclo[8.8.0.0¹,⁵.0⁴,⁸.0¹¹,¹⁶]octadec-14-ene-6,13,18-trione
(3ar,4r,6as,9ar,9bs)-6a-hydroxy-9-methyl-3,6-dimethylidene-2-oxo-3ah,4h,5h,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl (2z)-2,4-dihydroxybut-2-enoate
(1s,2r,6r,7s,9r,12s)-9-ethenyl-12-hydroxy-5,13-dimethylidene-4-oxo-3,11-dioxatricyclo[7.4.0.0²,⁶]tridecan-7-yl 2-(hydroxymethyl)prop-2-enoate
2-{[4a,5-dihydroxy-7-(hydroxymethyl)-1h,5h,7ah-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(2s)-2-(2-hydroxy-3,4,5-trimethoxyphenyl)-7-methoxy-3,4-dihydro-2h-1-benzopyran-8-ol
(1s,2s,3s,4e,8s,15s,17s)-2-hydroxy-1,8,17-trimethyl-7,14,18-trioxatetracyclo[10.5.2.0³,¹⁵.0¹⁵,¹⁹]nonadeca-4,12(19)-diene-6,11,13-trione
10-hydroxy-2,11-dimethyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradeca-1(13),2-dien-9-yl 2-methylpropanoate
(1s,5r,6s,8r,12r,14s)-8,12-dimethyl-2-methylidene-3,11-dioxo-4,7,15-trioxatetracyclo[10.2.1.0¹,⁵.0⁶,⁸]pentadecan-14-yl 2-methylprop-2-enoate
(2e,4s,6e)-4-hydroxy-8-(4-hydroxy-6-methoxy-1-oxo-3h-2-benzofuran-5-yl)-2,6-dimethylocta-2,6-dienoic acid
[(1s,2r,7s,9s,11s,13s)-7-(acetyloxy)-9,13-dimethyl-4,10-dioxo-3-oxatetracyclo[7.4.0.0²,⁶.0¹¹,¹³]tridec-5-en-5-yl]methyl acetate
(1s,4s,6r,7r,9s,11s)-4-hydroxy-9-methoxy-2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undecan-6-yl (2z)-3-(4-hydroxyphenyl)prop-2-enoate
(3ar,4s,5r,6s,7s,7ar)-7-hydroxy-6-methyl-3-methylidene-6-[(2r)-oxiran-2-yl]-2-oxo-5-(3-oxoprop-1-en-2-yl)-tetrahydro-3ah-1-benzofuran-4-yl 2-methylprop-2-enoate
6-o-cis-p-coumaroyl-3α-o-methyl-7-deoxy-rehmaglutin a
{"Ingredient_id": "HBIN012656","Ingredient_name": "6-o-cis-p-coumaroyl-3\u03b1-o-methyl-7-deoxy-rehmaglutin a","Alias": "NA","Ingredient_formula": "C19H22O7","Ingredient_Smile": "COC1CC2C(CC3(C2C(O1)OC3)O)OC(=O)C=CC4=CC=C(C=C4)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4171","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6-o-cis-p-coumaroyl-3β-o-methyl-7-deoxy-rehmaglutin a
{"Ingredient_id": "HBIN012657","Ingredient_name": "6-o-cis-p-coumaroyl-3\u03b2-o-methyl-7-deoxy-rehmaglutin a","Alias": "NA","Ingredient_formula": "C19H22O7","Ingredient_Smile": "COC1CC2C(CC3(C2C(O1)OC3)O)OC(=O)C=CC4=CC=C(C=C4)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4172","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6-o-trans-p-coumaroyl-3α-o-methyl-7-deoxy-rehmaglutin a
{"Ingredient_id": "HBIN012721","Ingredient_name": "6-o-trans-p-coumaroyl-3\u03b1-o-methyl-7-deoxy-rehmaglutin a","Alias": "NA","Ingredient_formula": "C19H22O7","Ingredient_Smile": "COC1CC2C(CC3(C2C(O1)OC3)O)OC(=O)C=CC4=CC=C(C=C4)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4173","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6-o-trans-p-coumaroyl-3β-o-methyl-7-deoxy-rehmaglutin a
{"Ingredient_id": "HBIN012722","Ingredient_name": "6-o-trans-p-coumaroyl-3\u03b2-o-methyl-7-deoxy-rehmaglutin a","Alias": "NA","Ingredient_formula": "C19H22O7","Ingredient_Smile": "COC1CC2C(CC3(C2C(O1)OC3)O)OC(=O)C=CC4=CC=C(C=C4)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4174","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
8α-epoxymethylacrylyloxyparthenin
{"Ingredient_id": "HBIN013625","Ingredient_name": "8\u03b1-epoxymethylacrylyloxyparthenin","Alias": "NA","Ingredient_formula": "C19H22O7","Ingredient_Smile": "CC1CC(C2C(C3(C1(C=CC3=O)O)C)OC(=O)C2=C)OC(=O)C4(CO4)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7171","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
8-Methoxysangu inarine
{"Ingredient_id": "HBIN013821","Ingredient_name": "8-Methoxysangu inarine","Alias": "NA","Ingredient_formula": "C21H16NO5+","Ingredient_Smile": "C[N+]1=C2C(=C3C=CC4=C(C3=C1OC)OCO4)C=CC5=CC6=C(C=C52)OCO6","Ingredient_weight": "362.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "37098","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101839187","DrugBank_id": "NA"}
9-o-acetylsalograviolide a
{"Ingredient_id": "HBIN014149","Ingredient_name": "9-o-acetylsalograviolide a","Alias": "NA","Ingredient_formula": "C19H22O7","Ingredient_Smile": "CC(=O)OC1CC2C(C1=C)C3C(C(C(C2=C)OC(=O)C)O)C(=C)C(=O)O3","Ingredient_weight": "362.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "504","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101036704","DrugBank_id": "NA"}