10,13-dimethyl-17-oxidanyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one; propanoate

Systemtic Name: 10,13-dimethyl-17-oxidanyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one; propanoate Openeye Name: 17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one; propanoate CAS Name: 17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one; propanoate IUPAC Name: 17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one; propanoate Traditional Name: 17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one; propionate Formula: C22H33O4- MolecularWeight: 361.49502

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)[O-].CC12CCC3C(C1CCC2O)CCC4=CC(=O)CCC34C

Isomeric SMILES

CCC(=O)[O-].CC12CCC3C(C1CCC2O)CCC4=CC(=O)CCC34C

InChI

InChI=1S/C19H28O2.C3H6O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18;1-2-3(4)5/h11,14-17,21H,3-10H2,1-2H3;2H2,1H3,(H,4,5)/p-1