[(E)-3-[(1S,4aS,5R,6R,8S,8aR)-3,8-diacetyloxy-1,6-dimethyl-2-[(2R)-octan-2-yl]-5-oxidanyl-4-oxidanylidene-4a,5,6,7,8,8a-hexahydronaphthalen-1-yl]-3-oxidanylidene-prop-1-enyl] ethanoate

Systemtic Name: [(E)-3-[(1S,4aS,5R,6R,8S,8aR)-3,8-diacetyloxy-1,6-dimethyl-2-[(2R)-octan-2-yl]-5-oxidanyl-4-oxidanylidene-4a,5,6,7,8,8a-hexahydronaphthalen-1-yl]-3-oxidanylidene-prop-1-enyl] ethanoate Openeye Name: [(E)-3-[(1S,4aS,5R,6R,8S,8aR)-3,8-diacetoxy-5-hydroxy-1,6-dimethyl-2-[(1R)-1-methylheptyl]-4-oxo-4a,5,6,7,8,8a-hexahydronaphthalen-1-yl]-3-oxo-prop-1-enyl] acetate CAS Name: acetic acid [(E)-3-[(1S,4aS,5R,6R,8S,8aR)-3,8-diacetyloxy-5-hydroxy-1,6-dimethyl-2-[(2R)-octan-2-yl]-4-oxo-4a,5,6,7,8,8a-hexahydronaphthalen-1-yl]-3-oxoprop-1-enyl] ester IUPAC Name: [(E)-3-[(1S,4aS,5R,6R,8S,8aR)-3,8-diacetyloxy-5-hydroxy-1,6-dimethyl-2-[(2R)-octan-2-yl]-4-oxo-4a,5,6,7,8,8a-hexahydronaphthalen-1-yl]-3-oxoprop-1-enyl] acetate Traditional Name: acetic acid [(E)-3-[(1S,4aS,5R,6R,8S,8aR)-3,8-diacetoxy-5-hydroxy-4-keto-1,6-dimethyl-2-[(1R)-1-methylheptyl]-4a,5,6,7,8,8a-hexahydronaphthalen-1-yl]-3-keto-prop-1-enyl] ester Formula: C29H42O9 MolecularWeight: 534.63838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C1=C(C(=O)C2C(C1(C)C(=O)C=COC(=O)C)C(CC(C2O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCC[C@@H](C)C1=C(C(=O)[C@H]2[C@H]([C@]1(C)C(=O)/C=C/OC(=O)C)[C@H](C[C@H]([C@H]2O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C29H42O9/c1-8-9-10-11-12-16(2)24-28(38-20(6)32)27(35)23-25(21(37-19(5)31)15-17(3)26(23)34)29(24,7)22(33)13-14-36-18(4)30/h13-14,16-17,21,23,25-26,34H,8-12,15H2,1-7H3/b14-13+/t16-,17-,21+,23+,25-,26-,29-/m1/s1