[(10S,13R,17R)-10,13-dimethyl-17-[(2R)-pentan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-1-yl] oxidanyl carbonate

Systemtic Name: [(10S,13R,17R)-10,13-dimethyl-17-[(2R)-pentan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-1-yl] oxidanyl carbonate Openeye Name: [(10S,13R,17R)-10,13-dimethyl-17-[(1R)-1-methylbutyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-1-yl] hydroxy carbonate CAS Name: carbonic acid [(10S,13R,17R)-10,13-dimethyl-17-[(2R)-pentan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-1-yl] hydroxy ester IUPAC Name: [(10S,13R,17R)-10,13-dimethyl-17-[(2R)-pentan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-1-yl] hydroxy carbonate Traditional Name: carbonic acid [(10S,13R,17R)-10,13-dimethyl-17-[(1R)-1-methylbutyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-1-yl] hydroxy ester Formula: C25H42O4 MolecularWeight: 406.59858

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1CCC2C1(CCC3C2CCC4C3(C(CCC4)OC(=O)OO)C)C

Isomeric SMILES

CCC[C@@H](C)[C@H]1CCC2[C@@]1(CCC3C2CCC4[C@@]3(C(CCC4)OC(=O)OO)C)C

InChI

InChI=1S/C25H42O4/c1-5-7-16(2)19-12-13-20-18-11-10-17-8-6-9-22(28-23(26)29-27)25(17,4)21(18)14-15-24(19,20)3/h16-22,27H,5-15H2,1-4H3/t16-,17?,18?,19-,20?,21?,22?,24-,25+/m1/s1