[15-ethyl-13-methyl-3,17-bis(oxidanyl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-10-yl]methyl methanesulfonate

Systemtic Name: [15-ethyl-13-methyl-3,17-bis(oxidanyl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-10-yl]methyl methanesulfonate Openeye Name: (15-ethyl-3,17-dihydroxy-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-10-yl)methyl methanesulfonate CAS Name: methanesulfonic acid (15-ethyl-3,17-dihydroxy-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-10-yl)methyl ester IUPAC Name: (15-ethyl-3,17-dihydroxy-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-10-yl)methyl methanesulfonate Traditional Name: methanesulfonic acid (15-ethyl-3,17-dihydroxy-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-10-yl)methyl ester Formula: C22H36O5S MolecularWeight: 412.58324

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(C2(C1C3CC=C4CC(CCC4(C3CC2)COS(=O)(=O)C)O)C)O

Isomeric SMILES

CCC1CC(C2(C1C3CC=C4CC(CCC4(C3CC2)COS(=O)(=O)C)O)C)O

InChI

InChI=1S/C22H36O5S/c1-4-14-11-19(24)21(2)9-8-18-17(20(14)21)6-5-15-12-16(23)7-10-22(15,18)13-27-28(3,25)26/h5,14,16-20,23-24H,4,6-13H2,1-3H3