methyl 2,2,6a,6b,9,9,12a-heptamethyl-3,10-bis(oxidanylidene)-1,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydropicene-4a-carboxylate

Systemtic Name: methyl 2,2,6a,6b,9,9,12a-heptamethyl-3,10-bis(oxidanylidene)-1,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydropicene-4a-carboxylate Openeye Name: methyl 2,2,6a,6b,9,9,12a-heptamethyl-3,10-dioxo-1,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydropicene-4a-carboxylate CAS Name: 2,2,6a,6b,9,9,12a-heptamethyl-3,10-dioxo-1,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydropicene-4a-carboxylic acid methyl ester IUPAC Name: methyl 2,2,6a,6b,9,9,12a-heptamethyl-3,10-dioxo-1,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydropicene-4a-carboxylate Traditional Name: 3,10-diketo-2,2,6a,6b,9,9,12a-heptamethyl-1,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydropicene-4a-carboxylic acid methyl ester Formula: C31H46O4 MolecularWeight: 482.69454

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2C3=CCC4C5(CCC(=O)C(C5CCC4(C3(CCC2(CC1=O)C(=O)OC)C)C)(C)C)C)C

Isomeric SMILES

CC1(CC2C3=CCC4C5(CCC(=O)C(C5CCC4(C3(CCC2(CC1=O)C(=O)OC)C)C)(C)C)C)C

InChI

InChI=1S/C31H46O4/c1-26(2)17-20-19-9-10-22-28(5)13-12-23(32)27(3,4)21(28)11-14-30(22,7)29(19,6)15-16-31(20,18-24(26)33)25(34)35-8/h9,20-22H,10-18H2,1-8H3