Exact Mass: 574.2479
Exact Mass Matches: 574.2479
Found 500 metabolites which its exact mass value is equals to given mass value 574.2479
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Tetrahydrofolyl-[Glu](2)
Tetrahydrofolyl-[Glu](n) is involved in the folate biosynthesis pathway. Tetrahydrofolyl-[Glu](n) can be reversibly converted into Tetrahydrofolyl-[Glu](2) by folylpolyglutamate synthase [EC:6.3.2.17]. Tetrahydrofolyl-[Glu](n) can be irreversibly converted into tetrahydrofolate by gamma-glutamyl hydrolase [EC:3.4.19.9]. [HMDB] Tetrahydrofolyl-[Glu](n) is involved in the folate biosynthesis pathway. Tetrahydrofolyl-[Glu](n) can be reversibly converted into Tetrahydrofolyl-[Glu](2) by folylpolyglutamate synthase [EC:6.3.2.17]. Tetrahydrofolyl-[Glu](n) can be irreversibly converted into tetrahydrofolate by gamma-glutamyl hydrolase [EC:3.4.19.9].
Austalide C
Austalide C is a metabolite of Aspergillus ustus. Metabolite of Aspergillus ustus.
para-hydroxyatorvastatin
para-hydroxyatorvastatin is a metabolite of atorvastatin. Atorvastatin, marketed by Pfizer as a calcium salt under the trade name Lipitor, is a member of the drug class known as statins, used for lowering blood cholesterol. It also stabilizes plaque and prevents strokes through anti-inflammatory and other mechanisms. Like all statins, atorvastatin works by inhibiting HMG-CoA reductase, an enzyme found in liver tissue that plays a key role in production of cholesterol in the body. (Wikipedia)
ortho-hydroxyatorvastatin
ortho-hydroxyatorvastatin is a metabolite of atorvastatin. Atorvastatin, marketed by Pfizer as a calcium salt under the trade name Lipitor, is a member of the drug class known as statins, used for lowering blood cholesterol. It also stabilizes plaque and prevents strokes through anti-inflammatory and other mechanisms. Like all statins, atorvastatin works by inhibiting HMG-CoA reductase, an enzyme found in liver tissue that plays a key role in production of cholesterol in the body. (Wikipedia)
4-Hydroxyatorvastatin
Chromozym PL
Cyclo(Arg-Gly-Asp-D-Phe-Val)
Toosendanin
Toosendanin, a triterpenoid extracted from the bark of fruit of Melia toosendan Sieb. et Zucc., possesses analgesic, insecticidal and anti-inflammatory activities[1]. Toosendanin, a triterpenoid extracted from the bark of fruit of Melia toosendan Sieb. et Zucc., possesses analgesic, insecticidal and anti-inflammatory activities[1].
2-Pyridinecarboximidamide, N,N'-(2,5-furandiylbis(3-(1-methylethoxy)-4,1-phenylene))bis-
(3R,5R)-7-[2-(4-Fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3-hydroperoxy-5-hydroxyheptanoic acid
Toosendanin
Toosendanin is a limonoid. Chuanliansu is a natural product found in Melia azedarach and Cedrela salvadorensis with data available. Toosendanin, a triterpenoid extracted from the bark of fruit of Melia toosendan Sieb. et Zucc., possesses analgesic, insecticidal and anti-inflammatory activities[1]. Toosendanin, a triterpenoid extracted from the bark of fruit of Melia toosendan Sieb. et Zucc., possesses analgesic, insecticidal and anti-inflammatory activities[1].
[3R-(3alpha,5beta,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 6,7,10-triacetate 5-benzoate 2H-3,9a-methano-1-benzoxepin-5,6,7,10-tetrol
Elaeodendroside F
A steroid lactone isolated from Elaeodendron tangenala and Elaeodendron glaucum and exhibits antiproliferative activity against A2780 human ovarian cancer cells.
Papulacandin D
A papulacandin that is papulacandin A in which the 6-O-acylgalactosyl group is replaced by a hydrogen. It is a carbohydrate-containing antibiotic from the deuteromycetous fungus Papularia sphaerosperma which shows potent antifungal activity against Candida albicans. D000890 - Anti-Infective Agents > D000935 - Antifungal Agents > D054714 - Echinocandins
5alpha-Carboxystrictosidine
(1S,2R,4S,9R,10R,14S,15S,17S)-9-(3-Furyl)-1-hydroxy-15-[(1R)-1-hydroxy-2-methoxy-2-oxoethyl]-10,14,16,16-tetramethyl-7,18-dioxo-3,8-dioxapentacyclo[12.3.1.02,4 04,13 05,10]octadec-17-yl propionate
2-methylbutanoic acid (3R,5R,5aS,6S,9S,9aS,10R)-10-(acetyloxy)-5a-[(acetyloxy)methyl]-5-(benzoyloxy)-octahydro-9-hydroxy-2,2,9-trimethyl-2H-3,9a-methano-1-benzoexepin-6-yl ester|6alpha,13-bis(acetyloxy)-9beta-(benzoyloxy)-4alpha-hydroxy-1beta-[(2-methylbutanoyl)oxy]-beta-dihydroagarofuran
1beta,2beta,8alpha,12-tetraacetoxy-9beta-benzoyloxy-beta-dihydroagarofuran|1beta,2beta,8alpha,13-Tetraacetoxy-9beta-benzoyloxy-beta-dihydroagarofuran|angulatueoid B
(19Xi)-19,20-epoxy-2-hydroxy-10-methoxy-4-methyl-16-(3t-phenyl-acryloyloxymethyl)-(2alpha,20betaH)-1,2,19,20-tetrahydro-4,5-seco-akuammilane-5,17-dioic acid 5->2-lactone 17-methyl ester|10-methoxy-lanciferine|10-Methoxylanciferin
O-beta-D-xylopyranosyl-(1->4)-O-3)>-O-beta-D-xylopyranosyl-(1->4)-D-xylopyranose|O-beta-D-xylopyranosyl-(1->4)-O-[alpha-L-arabinofuranosyl-(1->3)]-O-beta-D-xylopyranosyl-(1->4)-D-xylopyranose
13(R)-6alpha,11beta-dibenzoyloxy-7beta-hydroxy-8beta,13-epoxy-4(18)-neocleroden-15,16-olide|scutebatas P
(1S,4S,5S,6R,7R,8R,9S,10S)1,6,8,15-tetra-acetoxy-9-benzoyloxy-4-hydroxy-dihydro-beta-agarofuran
13(R)-1beta,6alpha-dibenzoyloxy-7beta-hydroxy-8beta,13-epoxy-4(18)-neocleroden-15,16-olide|scutebatas Q
(19Xi)-19,20-epoxy-2-hydroxy-10-methoxy-4-methyl-16-(3t-phenyl-acryloyloxymethyl)-(2alpha,20betaH)-1,2,19,20-tetrahydro-4,5-seco-akuammilane-5,17-dioic acid 5-lactone 17-methyl ester|10-Methoxy-lanciferin|10-methoxy-lanciferine
Asclepin (3-O-Acetyl-caltropin)|Asclepin (3-O-acetylcaltropin)
Glu Asp Arg Arg
Arg Glu Asp Arg
Isochuanliansu
Isotoosendanin is a limonoid that can be isolated from Melia toosendan fruit. Isotoosendanin displays significant anti-inflammatory and analgesic activities[1].
C31H42O10_7aH,13aH-Cyclopenta[7,8]phenanthro[2,3-b]pyrano[3,2-e][1,4]dioxin-13a-carboxaldehyde, 11-(acetyloxy)-1-(2,5-dihydro-5-oxo-3-furanyl)eicosahydro-3a,11a-dihydroxy-9,15a-dimethyl-, (1R,3aS,3bR,6aR,7aS,9R,11S,11aS,12aR,13aR,15aR)
C28H34N2O11_(1S,3S)-1-{[(2S,3R,4S)-2-(beta-D-Glucopyranosyloxy)-5-(methoxycarbonyl)-3-vinyl-3,4-dihydro-2H-pyran-4-yl]methyl}-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid
C30H38O11_7,11-Methano-2H,4H-oxireno[1,8]cycloocta[1,2-f][2]benzopyran-8-acetic acid, 4-(3-furanyl)dodecahydro-alpha,11-dihydroxy-4a,7,9,9-tetramethyl-2,13-dioxo-10-(1-oxopropoxy)-, methyl ester, (alphaR,4R,4aR,7S,8S,10S,11S,11aR,12aS)
C30H38O11_3H-4,11b-Propano-1H-oxireno[1,5]cyclopenta[1,2:5,6]naphtho[1,2-c]pyran-11(9H)-one, 10,14-bis(acetyloxy)-9-(3-furanyl)decahydro-3,6,12-trihydroxy-4,6a,9a-trimethyl-, (3R,4aR,6R,6aS,6bS,7aR,9S,9aR,10R,11aR,11bS,12S,14R)
C34H38O8_7,11-Methano-2H-cycloocta[3,4]benzo[1,2-c]pyran-8-acetic acid, 10-(benzoyloxy)-4-(3-furanyl)-1,4,4a,5,6,6a,7,8,9,10,11,12-dodecahydro-4a,7,9,9-tetramethyl-2,13-dioxo-, methyl ester, (4R,4aR,7R,8S,10R,11R)
(1S,2R,4S,9R,10R,14S,15S,17S)-9-(furan-3-yl)-1-hydroxy-15-[(1R)-1-hydroxy-2-methoxy-2-oxoethyl]-10,14,16,16-tetramethyl-7,18-dioxo-3,8-dioxapentacyclo[12.3.1.0²,⁴.0⁴,¹³.0⁵,¹⁰]octadecan-17-yl propanoate
(1S,3S)-1-[[(2S,3R,4S)-3-ethenyl-5-methoxycarbonyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
(1S,2R,4S,9R,10R,14S,15S,17S)-9-(furan-3-yl)-1-hydroxy-15-[(1R)-1-hydroxy-2-methoxy-2-oxoethyl]-10,14,16,16-tetramethyl-7,18-dioxo-3,8-dioxapentacyclo[12.3.1.0²,⁴.0⁴,¹³.0⁵,¹⁰]octadecan-17-yl propanoate_major
(1S,2R,4S,9R,10R,14S,15S,17S)-9-(furan-3-yl)-1-hydroxy-15-[(1R)-1-hydroxy-2-methoxy-2-oxoethyl]-10,14,16,16-tetramethyl-7,18-dioxo-3,8-dioxapentacyclo[12.3.1.0²,⁴.0⁴,¹³.0⁵,¹⁰]octadecan-17-yl propanoate_100.0\\%
(1S,2R,4S,9R,10R,14S,15S,17S)-9-(furan-3-yl)-1-hydroxy-15-[(1R)-1-hydroxy-2-methoxy-2-oxoethyl]-10,14,16,16-tetramethyl-7,18-dioxo-3,8-dioxapentacyclo[12.3.1.0²,?.0?,¹³.0?,¹?]octadecan-17-yl propanoate
Asp Glu Arg Arg
Asp Phe Phe Phe
Asp Phe Met Tyr
Asp Phe Tyr Met
Asp Met Phe Tyr
Asp Met Tyr Phe
Asp Arg Glu Arg
Asp Arg Arg Glu
Asp Arg Val Trp
Asp Arg Trp Val
Asp Val Arg Trp
Asp Val Trp Arg
Asp Trp Arg Val
Asp Trp Val Arg
Asp Tyr Phe Met
Asp Tyr Met Phe
Glu Ile Gln Trp
Glu Ile Trp Gln
Glu Leu Gln Trp
Glu Leu Trp Gln
Glu Gln Ile Trp
Glu Gln Leu Trp
Glu Gln Trp Ile
Glu Gln Trp Leu
Glu Arg Asp Arg
Glu Arg Arg Asp
Glu Thr Tyr Tyr
Glu Trp Ile Gln
Glu Trp Leu Gln
Glu Trp Gln Ile
Glu Trp Gln Leu
Glu Tyr Thr Tyr
Glu Tyr Tyr Thr
Phe Asp Phe Phe
Phe Asp Met Tyr
Phe Asp Tyr Met
Phe Phe Asp Phe
Phe Phe Phe Asp
Phe Phe Met Met
Phe Phe Val Tyr
Phe Phe Tyr Val
Phe Met Asp Tyr
Phe Met Phe Met
Phe Met Met Phe
Phe Met Tyr Asp
Phe Val Phe Tyr
Phe Val Tyr Phe
Phe Tyr Asp Met
Phe Tyr Phe Val
Phe Tyr Met Asp
Phe Tyr Val Phe
His Lys Gln Tyr
His Lys Tyr Gln
His Gln Lys Tyr
His Gln Gln Tyr
His Gln Tyr Lys
His Gln Tyr Gln
His Tyr Lys Gln
His Tyr Gln Lys
His Tyr Gln Gln
Ile Glu Gln Trp
Ile Glu Trp Gln
Ile Gln Glu Trp
Ile Gln Trp Glu
Ile Trp Glu Gln
Ile Trp Gln Glu
Lys His Gln Tyr
Lys His Tyr Gln
Lys Asn Gln Trp
Lys Asn Trp Gln
Lys Gln His Tyr
Lys Gln Asn Trp
Lys Gln Trp Asn
Lys Gln Tyr His
Lys Trp Asn Gln
Lys Trp Gln Asn
Lys Tyr His Gln
Lys Tyr Gln His
Leu Glu Gln Trp
Leu Glu Trp Gln
Leu Gln Glu Trp
Leu Gln Trp Glu
Leu Trp Glu Gln
Leu Trp Gln Glu
Met Asp Phe Tyr
Met Asp Tyr Phe
Met Phe Asp Tyr
Met Phe Phe Met
Met Phe Met Phe
Met Phe Tyr Asp
Met Met Phe Phe
Met Val Tyr Tyr
Met Tyr Asp Phe
Met Tyr Phe Asp
Met Tyr Val Tyr
Met Tyr Tyr Val
Asn Lys Gln Trp
Asn Lys Trp Gln
Asn Gln Lys Trp
Asn Gln Gln Trp
Asn Gln Trp Lys
Asn Gln Trp Gln
Asn Trp Lys Gln
Asn Trp Gln Lys
Asn Trp Gln Gln
Pro Ser Trp Trp
Pro Trp Ser Trp
Pro Trp Trp Ser
Gln Glu Ile Trp
Gln Glu Leu Trp
Gln Glu Trp Ile
Gln Glu Trp Leu
Gln His Lys Tyr
Gln His Gln Tyr
Gln His Tyr Lys
Gln His Tyr Gln
Gln Ile Glu Trp
Gln Ile Trp Glu
Gln Lys His Tyr
Gln Lys Asn Trp
Gln Lys Trp Asn
Gln Leu Glu Trp
Gln Leu Trp Glu
Gln Asn Gln Trp
Gln Asn Trp Gln
Gln Gln His Tyr
Gln Gln Asn Trp
Gln Gln Trp Asn
Gln Gln Tyr His
Gln Trp Glu Ile
Gln Trp Glu Leu
Gln Trp Ile Glu
Gln Trp Leu Glu
Gln Trp Asn Gln
Gln Trp Gln Asn
Gln Tyr His Gln
Gln Tyr Gln His
Arg Asp Glu Arg
Arg Asp Arg Glu
Arg Glu Arg Asp
Arg Arg Asp Glu
Arg Arg Glu Asp
Ser Pro Trp Trp
Ser Trp Pro Trp
Ser Trp Trp Pro
Thr Glu Tyr Tyr
Thr Tyr Glu Tyr
Thr Tyr Tyr Glu
Val Phe Phe Tyr
Val Phe Tyr Phe
Val Met Tyr Tyr
Val Tyr Phe Phe
Val Tyr Met Tyr
Val Tyr Tyr Met
Trp Glu Ile Gln
Trp Glu Leu Gln
Trp Glu Gln Ile
Trp Glu Gln Leu
Trp Ile Glu Gln
Trp Ile Gln Glu
Trp Leu Glu Gln
Trp Leu Gln Glu
Trp Asn Gln Gln
Trp Pro Ser Trp
Trp Pro Trp Ser
Trp Gln Glu Ile
Trp Gln Glu Leu
Trp Gln Ile Glu
Trp Gln Leu Glu
Trp Gln Asn Gln
Trp Gln Gln Asn
Trp Ser Pro Trp
Trp Ser Trp Pro
Trp Trp Pro Ser
Trp Trp Ser Pro
Tyr Asp Phe Met
Tyr Asp Met Phe
Tyr Glu Thr Tyr
Tyr Glu Tyr Thr
Tyr Phe Asp Met
Tyr Phe Phe Val
Tyr Phe Met Asp
Tyr Phe Val Phe
Tyr His Gln Gln
Tyr Met Asp Phe
Tyr Met Phe Asp
Tyr Met Val Tyr
Tyr Met Tyr Val
Tyr Gln His Gln
Tyr Gln Gln His
Tyr Thr Glu Tyr
Tyr Thr Tyr Glu
Tyr Val Phe Phe
Tyr Val Met Tyr
Tyr Val Tyr Met
Tyr Tyr Glu Thr
Tyr Tyr Met Val
Tyr Tyr Thr Glu
Tyr Tyr Val Met
Austalide C
Benzoic acid,3,4,5-trimethoxy-,2-(4-morpholinyl)-1-[(6,7,8-trimethoxy-4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]ethylester
(6S)-6-[5-[7-[2-(1R,3S,4S)-2-azabicyclo[2.2.1]hept-3-yl-1H-benzimidazol-6-yl]-9,9-difluoro-9H-fluoren-2-yl]-1H-imidazol-2-yl]-5-Azaspiro[2.4]heptane
2-Pyridinecarboximidamide, N,N-(2,5-furandiylbis(3-(1-methylethoxy)-4,1-phenylene))bis-
N-{4-[(1-Hydroxycarbamoyl-2-methyl-propyl)-(2-morpholin-4-YL-ethyl)-sulfamoyl]-4-pentyl-benzamide
(2S)-3alpha-Ethenyl-2beta-(beta-D-glucopyranosyloxy)-3,4-dihydro-4alpha-[[(1S,3R)-2,3,4,9-tetrahydro-3-carboxy-1H-pyrido[3,4-b]indol-1-yl]methyl]-2H-pyran-5-carboxylic acid 5-methyl ester
(1S)-1-[[(2S,3R,4S)-3-ethenyl-5-methoxycarbonyl-2-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-3-carboxylate
(1S)-1-[[(2S,3R,4S)-3-ethenyl-5-methoxycarbonyl-2-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
(2S)-2-[[(2S)-2-[[4-[[(6S)-2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pteridin-6-yl]methylamino]benzoyl]amino]-4-carboxybutanoyl]amino]pentanedioic acid
7-[2-(4-Fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,4,5-trihydroxyheptanoic acid
(3R,5R)-7-[2-(4-Fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3-hydroperoxy-5-hydroxyheptanoic acid
elaeodendroside G
A steroid lactone isolated from Elaeodendron tangenala and Elaeodendron glaucum and exhibits antiproliferative activity against A2780 human ovarian cancer cells.
7-O-Nicotinoyl scutebarbatine H, (rel)
A natural product found in Scutellaria barbata.
3alpha,20alpha-dihydroxy-5beta-pregnane 3-O-(3-sulfo-beta-D-glucuronate)
alpha-D-GalpNAc-(1->2)-alpha-DD-Hepp-(1->6)-alpha-D-GlcpN
N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-phenylacetamide
1-[(1R)-1-(hydroxymethyl)-7-methoxy-2-(4-methylphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]-2-(3-pyridinyl)ethanone
N-[(4R,7R,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(5-pyrimidinylmethyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide
N-[(4S,7R,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(5-pyrimidinylmethyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide
N-[(4R,7S,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(5-pyrimidinylmethyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide
N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-phenylacetamide
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-phenylacetamide
N-[(4S,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(5-pyrimidinylmethyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide
N-[(4S,7S,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(5-pyrimidinylmethyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide
(1R)-N-(4-fluorophenyl)-1-[(2-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4-piperidine]carboxamide
N-[(4R,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(5-pyrimidinylmethyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide
N-[(4R,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(5-pyrimidinylmethyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide
N-[(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(5-pyrimidinylmethyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzothiazole-2-carboxamide
1-[(1S)-1-(hydroxymethyl)-7-methoxy-2-(4-methylphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]-2-(3-pyridinyl)ethanone
(1S)-N-(4-fluorophenyl)-1-[(2-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4-piperidine]carboxamide
[(1S,2R,4S,5R,9R,10R,14S,15S,17S)-9-(furan-3-yl)-1-hydroxy-15-[(1R)-1-hydroxy-2-methoxy-2-oxoethyl]-10,14,16,16-tetramethyl-7,18-dioxo-3,8-dioxapentacyclo[12.3.1.02,4.04,13.05,10]octadecan-17-yl] propanoate
7-[2-(4-Fluorophenyl)-4-[(2-hydroxyphenyl)carbamoyl]-3-phenyl-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid
methyl 5-ethylidene-4-(2-{[3-hydroxy-5-(1-hydroxypropan-2-yl)-2-methylcyclopentyl]methoxy}-2-oxoethyl)-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylate
(1s,3's,4's,5'r,6'r)-3',5,5',7-tetrahydroxy-6'-(hydroxymethyl)-3h-spiro[2-benzofuran-1,2'-oxan]-4'-yl (2e,4e,7r,8z,10z,14s)-7-hydroxy-8,14-dimethylhexadeca-2,4,8,10-tetraenoate
(1s,2s,4r,5r,6r,9r,10s,11r,13r,14r,18s,20r)-20-(acetyloxy)-6-(furan-3-yl)-11,15,18-trihydroxy-5,10,14-trimethyl-3,8-dioxo-16-oxapentacyclo[12.3.3.0¹,¹³.0²,¹⁰.0⁵,⁹]icosan-4-yl acetate
(8r,9s,10r,11r)-11-(acetyloxy)-3,9-dihydroxy-4,5,14,15,16-pentamethoxy-9,10-dimethyltricyclo[10.4.0.0²,⁷]hexadeca-1(12),2,4,6,13,15-hexaen-8-yl (2z)-2-methylbut-2-enoate
(3as,5s,9r,11ar)-6,10-dimethyl-3-methylidene-2-oxo-9-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-5-yl 2-(4-methoxyphenyl)acetate
(1s,2r,4s,7s,8s,10s,11r,12r,13s,18r,20r)-13-(acetyloxy)-7-(furan-3-yl)-10-hydroxy-1,8,12,17,17-pentamethyl-5,15-dioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icosan-20-yl acetate
(1s,3s)-1-{[(2s,3s,4s)-3-ethenyl-5-(methoxycarbonyl)-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-pyran-4-yl]methyl}-1h,2h,3h,4h,9h-pyrido[3,4-b]indole-3-carboxylic acid
(1's,2s,2'r,7'r,11'r)-2'-({[(2e)-5-hydroxy-3-methylpent-2-enoyl]oxy}methyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl (2z,4e,6s)-7-(acetyloxy)-6-hydroxyocta-2,4-dienoate
(1s,2r,4r,5r,6s,8r,10s,11s,12r,14r,15r,16r,19s,21s)-21-(acetyloxy)-6-(furan-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-4-yl acetate
4,9,13-tris(acetyloxy)-3,6,6,10,14-pentamethyl-2-oxo-16-oxatetracyclo[10.3.1.0¹,¹².0⁵,⁷]hexadec-10-en-8-yl 2-methylbut-2-enoate
5-[(1s,3r,5s,6r,9r,10r,13r,14r,16s,18r,20r,22s,24s,25r,26r)-13,25,26-trihydroxy-1-methoxy-5,9,24-trimethyl-2,15,21,23-tetraoxaheptacyclo[20.3.1.0³,²⁰.0⁵,¹⁸.0⁶,¹⁴.0⁹,¹³.0¹⁴,¹⁶]hexacosan-10-yl]pyran-2-one
methyl (4s,5e,6s)-5-ethylidene-4-(2-{[(1s,2r,3r,4s)-3-(hydroxymethyl)-4-[(2s)-1-hydroxypropan-2-yl]-2-methylcyclopentyl]oxy}-2-oxoethyl)-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylate
methyl (4s,5z,6s)-5-ethylidene-4-(2-{[(1s,2s,3s,4s)-3-(hydroxymethyl)-4-(1-hydroxypropan-2-yl)-2-methylcyclopentyl]oxy}-2-oxoethyl)-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylate
(1r,2s,4r,5s,6r,7s,8r,9r)-4,5,8-tris(acetyloxy)-6-[(acetyloxy)methyl]-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate
(1s,2s,3s,3as,4r,5s,9s,11r,13as)-3a,9-bis(acetyloxy)-3,4,5,11-tetrahydroxy-2,5,8,8,12-pentamethyl-1h,2h,3h,4h,9h,10h,11h,13ah-cyclopenta[12]annulen-1-yl benzoate
(1s,3s)-1-{[(2s,3r,4s)-3-ethenyl-5-(methoxycarbonyl)-2-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-pyran-4-yl]methyl}-1h,2h,3h,4h,9h-pyrido[3,4-b]indole-3-carboxylic acid
(1r,2r,3r,6r,8s,11s,12s,13s,14r,15r,16s,17s)-2,3,12,15,16-pentahydroxy-9,13,17-trimethyl-11-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,18-dioxapentacyclo[12.5.0.0¹,⁶.0²,¹⁷.0⁸,¹³]nonadec-9-en-4-one
5-{7,13,26-trihydroxy-1-methoxy-5,9,24-trimethyl-2,15,21,23-tetraoxaheptacyclo[20.3.1.0³,²⁰.0⁵,¹⁸.0⁶,¹⁴.0⁹,¹³.0¹⁴,¹⁶]hexacosan-10-yl}pyran-2-one
(1s,2r,4s,5r,6r,7s,9r,12s)-4,5,12-tris(acetyloxy)-6-[(acetyloxy)methyl]-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate
5-[(1s,3r,5s,6s,7r,9r,10r,13r,14r,16s,18r,20r,22s,24s,26s)-7,13,26-trihydroxy-1-methoxy-5,9,24-trimethyl-2,15,21,23-tetraoxaheptacyclo[20.3.1.0³,²⁰.0⁵,¹⁸.0⁶,¹⁴.0⁹,¹³.0¹⁴,¹⁶]hexacosan-10-yl]pyran-2-one
(1s,2r,4r,5r,6s,8r,10r,11s,12r,14r,15r,16r,19s,21r)-21-(acetyloxy)-6-(furan-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-4-yl acetate
11β-hydroxycneorin g
{"Ingredient_id": "HBIN000368","Ingredient_name": "11\u03b2-hydroxycneorin g","Alias": "NA","Ingredient_formula": "C30H38O11","Ingredient_Smile": "CC(=O)OC1CC2C(OC(=O)CC(C2(C3C1(C45C(O4)C(=O)OC(C5(CC3O)C)C6=COC=C6)C)C)OC(=O)C)(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9926","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1α,6β,8β,14-tetraacetoxy-9β-benzoyloxydi-hydro-β-agarofuran
{"Ingredient_id": "HBIN002296","Ingredient_name": "1\u03b1,6\u03b2,8\u03b2,14-tetraacetoxy-9\u03b2-benzoyloxydi-hydro-\u03b2-agarofuran","Alias": "NA","Ingredient_formula": "C30H38O11","Ingredient_Smile": "CC1CCC(C2(C13C(C(C(C2OC(=O)C4=CC=CC=C4)OC(=O)C)C(O3)(C)C)OC(=O)C)COC(=O)C)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21008","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7-0-nicotinoylscutebarbatine H
{"Ingredient_id": "HBIN012844","Ingredient_name": "7-0-nicotinoylscutebarbatine H","Alias": "NA","Ingredient_formula": "C32H34N2O8","Ingredient_Smile": "CC1=CCCC2C1(C(C(C(C2(C)C3CC4=C(O3)C(=O)OC4)(C)O)OC(=O)C5=CN=CC=C5)OC(=O)C6=CN=CC=C6)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32877","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
Barbatin A
{"Ingredient_id": "HBIN017589","Ingredient_name": "Barbatin A","Alias": "NA","Ingredient_formula": "C34H38O8","Ingredient_Smile": "CC1=CCCC2C1(C(C(C3(C2(C(CC4(O3)CC(=O)OC4)OC(=O)C5=CC=CC=C5)C)C)O)OC(=O)C6=CC=CC=C6)C","Ingredient_weight": "574.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32735","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "16081675","DrugBank_id": "NA"}
Barbatin B
{"Ingredient_id": "HBIN017590","Ingredient_name": "Barbatin B","Alias": "NA","Ingredient_formula": "C34H38O8","Ingredient_Smile": "CC12C3CCCC(=C)C3(C(C(C1(OC4(CC2O)CC(=O)OC4)C)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6)C","Ingredient_weight": "574.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32736","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "16081677","DrugBank_id": "NA"}