methyl (4aS,6aR,12aR,12bS)-4,4,6a,12b-tetramethyl-8-oxidanyl-1,2,3,4a,5,6,12,12a-octahydrobenzo[a]xanthene-10-carboxylate

Systemtic Name: methyl (4aS,6aR,12aR,12bS)-4,4,6a,12b-tetramethyl-8-oxidanyl-1,2,3,4a,5,6,12,12a-octahydrobenzo[a]xanthene-10-carboxylate Openeye Name: methyl (4aS,6aR,12aR,12bS)-8-hydroxy-4,4,6a,12b-tetramethyl-1,2,3,4a,5,6,12,12a-octahydrobenzo[a]xanthene-10-carboxylate CAS Name: (4aS,6aR,12aR,12bS)-8-hydroxy-4,4,6a,12b-tetramethyl-1,2,3,4a,5,6,12,12a-octahydrobenzo[a]xanthene-10-carboxylic acid methyl ester IUPAC Name: methyl (4aS,6aR,12aR,12bS)-8-hydroxy-4,4,6a,12b-tetramethyl-1,2,3,4a,5,6,12,12a-octahydrobenzo[a]xanthene-10-carboxylate Traditional Name: (4aS,6aR,12aR,12bS)-8-hydroxy-4,4,6a,12b-tetramethyl-1,2,3,4a,5,6,12,12a-octahydrobenzo[a]xanthene-10-carboxylic acid methyl ester Formula: C23H32O4 MolecularWeight: 372.49778

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2(C1CCC3(C2CC4=C(O3)C(=CC(=C4)C(=O)OC)O)C)C)C

Isomeric SMILES

C[C@]12CCCC([C@@H]1CC[C@@]3([C@@H]2CC4=C(O3)C(=CC(=C4)C(=O)OC)O)C)(C)C

InChI

InChI=1S/C23H32O4/c1-21(2)8-6-9-22(3)17(21)7-10-23(4)18(22)13-14-11-15(20(25)26-5)12-16(24)19(14)27-23/h11-12,17-18,24H,6-10,13H2,1-5H3/t17-,18+,22-,23+/m0/s1