[(2S,4aS,6R,7R,8aR)-7-acetyloxy-6-[(6S)-1,3-dimethyl-2,4,7-tris(oxidanylidene)-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-6-yl]-8a-methyl-4-methylidene-1,2,3,4a,5,6,7,8-octahydronaphthalen-2-yl] ethanoate

Systemtic Name: [(2S,4aS,6R,7R,8aR)-7-acetyloxy-6-[(6S)-1,3-dimethyl-2,4,7-tris(oxidanylidene)-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-6-yl]-8a-methyl-4-methylidene-1,2,3,4a,5,6,7,8-octahydronaphthalen-2-yl] ethanoate Openeye Name: [(2S,4aS,6R,7R,8aR)-7-acetoxy-6-[(6S)-1,3-dimethyl-2,4,7-trioxo-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-6-yl]-8a-methyl-4-methylene-decalin-2-yl] acetate CAS Name: acetic acid [(2S,4aS,6R,7R,8aR)-7-acetyloxy-6-[(6S)-1,3-dimethyl-2,4,7-trioxo-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-6-yl]-8a-methyl-4-methylene-1,2,3,4a,5,6,7,8-octahydronaphthalen-2-yl] ester IUPAC Name: [(2S,4aS,6R,7R,8aR)-7-acetyloxy-6-[(6S)-1,3-dimethyl-2,4,7-trioxo-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-6-yl]-8a-methyl-4-methylidene-1,2,3,4a,5,6,7,8-octahydronaphthalen-2-yl] acetate Traditional Name: acetic acid [(2S,4aS,6R,7R,8aR)-7-acetoxy-8a-methyl-4-methylene-6-[(6S)-2,4,7-triketo-1,3-dimethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-6-yl]decalin-2-yl] ester Formula: C25H33N3O7 MolecularWeight: 487.54542

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(=C)C2CC(C(CC2(C1)C)OC(=O)C)C3CC4=C(NC3=O)N(C(=O)N(C4=O)C)C

Isomeric SMILES

CC(=O)O[C@H]1CC(=C)[C@@H]2C[C@@H]([C@@H](C[C@]2(C1)C)OC(=O)C)[C@@H]3CC4=C(NC3=O)N(C(=O)N(C4=O)C)C

InChI

InChI=1S/C25H33N3O7/c1-12-7-15(34-13(2)29)10-25(4)11-20(35-14(3)30)16(9-19(12)25)17-8-18-21(26-22(17)31)27(5)24(33)28(6)23(18)32/h15-17,19-20H,1,7-11H2,2-6H3,(H,26,31)/t15-,16+,17-,19-,20+,25+/m0/s1