Nimbin

methyl (1S,2R,3R,4R,8R,9S,10R,13R,15R)-2-acetyloxy-13-(furan-3-yl)-9-(2-methoxy-2-oxoethyl)-4,8,10,12-tetramethyl-7-oxo-16-oxatetracyclo[8.6.0.03,8.011,15]hexadeca-5,11-diene-4-carboxylate

Also Known As: Nimbin|Nimbin (chemical)|NIMBIN [MI]|HY-N3187|NP6281|FS-9292|4CN-2559|SID:476001098|AQ-152/42730366|methyl (1S,2R,3R,4R,8R,9S,10R,13R,15R)-2-acetyloxy-13-(furan-3-yl)-9-(2-methoxy-2-oxoethyl)-4,8,10,12-tetramethyl-7-oxo-16-oxatetracyclo[8.6.0.03,8.011,15]hexadeca-5,11-diene-4-carboxylate|2H-CYCLOPENTA(B)NAPHTHO(2,3-D)FURAN-10-ACETIC ACID, 5-(ACETYLOXY)-2-(3-FURANYL)-3,3A,4A,5,5A,6,9,9A,10,10A-DECAHYDRO-6-(METHOXYCARBONYL)-1,6,9A,10A-TETRAMETHYL-9-OXO-, METHYL ESTER, (2R,3AR,4AS,5R,5AR,6R,9AR,10S,10AR)-|methyl (2R,3aR,4aS,5R,5aR,6R,9aR,10S,10aR)-5-(acetyloxy)-2-(furan-3-yl)-10-(2-methoxy-2-oxoethyl)-1,6,9a,10a-tetramethyl-9-oxo-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-2H-cyclopenta[b]naphtho[2,3-d]furan-6-carboxylate|(17alpha)-6alpha-Acetoxy-7alpha,15beta:21,23-diepoxy-4beta,8-dimethyl-1-oxo-18,24-dinor-11,12-seco-5alpha-chola-2,13,20,22-tetrene-4alpha,11-dicarboxylic acid dimethyl ester|(4alpha,5alpha,6alpha,7alpha,15beta,17alpha)-6-(Acetyloxy)-7,15:21,23-Diepoxy-4,8-dimethyl-1-oxo- 18,24-dinor-11,12-secochola-2,13,20,22-tetraene-4,11-dicarboxylic Acid Dimethyl Ester|(4alpha,5alpha,6alpha,7alpha,15beta,17alpha)-6-(acetyloxy)-7,15:21,23-diepoxy-4,8-dimethyl-1-oxo-8,24-dinor-11,12-secochola-2,13,20,22-tetraene-4,11-dicarboxylic acid methyl ester|18,24-Dinor-11,12-secochola-2,13,20,22-tetraene-4,11-dicarboxylic acid, 6-(acetyloxy)-7,15:21,23-diepoxy-4,8-dimethyl-1-oxo-, dimethyl ester, (4alpha,5alpha,6alpha,7alpha,15beta,17alpha)-|18,24-Donor-11,12-secochola-2,13,20,22-tetraene-4,11-dicarboxylic acid, 6-(acetyloxy)-7,15:21,23-diepoxy-4,8-dimethyl-1-oxo-, dimethyl ester, (4.alpha.,5.alpha.,6.alpha.,7.alpha.,15.beta.,17.alpha.)-|2H-Cyclopenta(b)naphtho(2,3-d)furan-10-acetic acid, 5-(acetyloxy)-2-(3-furanyl)-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-6-(methoxycarbonyl)-1,6,9a,10a-tetamethyl-9-oxo-, methyl ester, (2R,3aR,4aS,5R,5aR,6R,9aR,10S,10aR)-|2H-Cyclopenta[b]naphtho[2,3-d]furan-10-acetic acid, 6.alpha.-carboxy-2.alpha.-(3-furyl)-3,3a.alpha.,4a.beta.,5,5a.alpha.,6,9,9a,10.alpha.,10a-decahydro-5.alpha.-hydroxy-1,6,9a.beta.,10a.beta.-tetramethyl-9-oxo-, dimethyl ester, acetate|611-830-3|methyl (1S,2R,3R,4R,8R,9S,10R,13R,15R)-2-(acetyloxy)-13-(furan-3-yl)-9-(2-methoxy-2-oxoethyl)-4,8,10,12-tetramethyl-7-oxo-16-oxatetracyclo[8.6.0.03,8.011,15]hexadeca-5,11-diene-4-carboxylate|methyl (1S,2R,3R,4R,8R,9S,10R,13R,15R)-2-acetoxy-13-(3-furyl)-9-(2-methoxy-2-oxo-ethyl)-4,8,10,12-tetramethyl-7-oxo-16-oxatetracyclo[8.6.0.03,8.011,15]hexadeca-5,11-diene-4-carboxylate

Molecular Formula	C30H36O9
Molecular Weight	540.23596 g/mol
LogP	3.92
Topological Polar Surface Area	118.34 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	9
Rotatable Bonds	5
Exact Mass	540.23596
Heavy Atoms	39
Complexity	1275.1

Chemical Identifiers

CAS Number	5945-86-8
SMILES	CC1=C2[C@@H](C[C@H]1C3=COC=C3)O[C@H]4[C@@]2([C@@H]([C@@]5([C@@H]([C@H]4OC(=O)C)[C@](C=CC5=O)(C)C(=O)OC)C)CC(=O)OC)C