(7R,10S,13S,17R)-7-ethylsulfanyl-10,13-dimethyl-spiro[2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione

Systemtic Name: (7R,10S,13S,17R)-7-ethylsulfanyl-10,13-dimethyl-spiro[2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione Openeye Name: (7R,10S,13S,17R)-7-ethylsulfanyl-10,13-dimethyl-spiro[2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-tetrahydrofuran]-2',3-dione CAS Name: (7R,10S,13S,17R)-7-(ethylthio)-10,13-dimethylspiro[2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione IUPAC Name: (7R,10S,13S,17R)-7-ethylsulfanyl-10,13-dimethylspiro[2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione Traditional Name: (7R,10S,13S,17R)-7-(ethylthio)-10,13-dimethyl-spiro[2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-tetrahydrofuran]-2',3-quinone Formula: C24H32O3S MolecularWeight: 400.57408

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1CC2=CC(=O)CCC2(C3=CCC4(C(C13)CCC45CCC(=O)O5)C)C

Isomeric SMILES

CCS[C@@H]1CC2=CC(=O)CC[C@@]2(C3=CC[C@]4(C(C13)CC[C@@]45CCC(=O)O5)C)C

InChI

InChI=1S/C24H32O3S/c1-4-28-19-14-15-13-16(25)5-9-22(15,2)17-6-10-23(3)18(21(17)19)7-11-24(23)12-8-20(26)27-24/h6,13,18-19,21H,4-5,7-12,14H2,1-3H3/t18?,19-,21?,22+,23+,24-/m1/s1