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

Systemtic Name: 10,13-dimethyl-17-oxidanyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one; dodecanoate Openeye Name: dodecanoate; 17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one CAS Name: dodecanoate; 17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one IUPAC Name: dodecanoate; 17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Traditional Name: 17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one; laurate Formula: C31H51O4- MolecularWeight: 487.73424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28O2.C12H24O2/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;1-2-3-4-5-6-7-8-9-10-11-12(13)14/h11,14-17,21H,3-10H2,1-2H3;2-11H2,1H3,(H,13,14)/p-1