S-[(1R,3aS,3bR,4R,9aR,9bS,11aS)-9a,11a-dimethyl-5',7-bis(oxidanylidene)spiro[2,3,3a,3b,4,5,9,9b,10,11-decahydroindeno[4,5-h]isochromene-1,2'-oxolane]-4-yl] ethanethioate

Systemtic Name: S-[(1R,3aS,3bR,4R,9aR,9bS,11aS)-9a,11a-dimethyl-5',7-bis(oxidanylidene)spiro[2,3,3a,3b,4,5,9,9b,10,11-decahydroindeno[4,5-h]isochromene-1,2'-oxolane]-4-yl] ethanethioate Openeye Name: S-[(1R,3aS,3bR,4R,9aR,9bS,11aS)-9a,11a-dimethyl-5',7-dioxo-spiro[2,3,3a,3b,4,5,9,9b,10,11-decahydroindeno[4,5-h]isochromene-1,2'-tetrahydrofuran]-4-yl] ethanethioate CAS Name: ethanethioic acid S-[(1R,3aS,3bR,4R,9aR,9bS,11aS)-9a,11a-dimethyl-5',7-dioxo-4-spiro[2,3,3a,3b,4,5,9,9b,10,11-decahydroindeno[4,5-h][2]benzopyran-1,2'-oxolane]yl] ester IUPAC Name: S-[(1R,3aS,3bR,4R,9aR,9bS,11aS)-9a,11a-dimethyl-5',7-dioxospiro[2,3,3a,3b,4,5,9,9b,10,11-decahydroindeno[4,5-h]isochromene-1,2'-oxolane]-4-yl] ethanethioate Traditional Name: ethanethioic acid S-[(1R,3aS,3bR,4R,9aR,9bS,11aS)-5',7-diketo-9a,11a-dimethyl-spiro[2,3,3a,3b,4,5,9,9b,10,11-decahydroinden[4,5-h]isochromene-1,2'-tetrahydrofuran]-4-yl] ester Formula: C23H30O5S MolecularWeight: 418.5463

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CC2=CC(=O)OCC2(C3C1C4CCC5(C4(CC3)C)CCC(=O)O5)C

Isomeric SMILES

CC(=O)S[C@@H]1CC2=CC(=O)OC[C@@]2([C@@H]3[C@@H]1[C@@H]4CC[C@]5([C@]4(CC3)C)CCC(=O)O5)C

InChI

InChI=1S/C23H30O5S/c1-13(24)29-17-10-14-11-19(26)27-12-21(14,2)15-4-7-22(3)16(20(15)17)5-8-23(22)9-6-18(25)28-23/h11,15-17,20H,4-10,12H2,1-3H3/t15-,16-,17+,20+,21-,22-,23+/m0/s1