(8S,11S,13S,17S)-8-ethyl-11-hexyl-13-methyl-17-oxidanyl-7,9,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthrene-3-sulfonamide

Systemtic Name: (8S,11S,13S,17S)-8-ethyl-11-hexyl-13-methyl-17-oxidanyl-7,9,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthrene-3-sulfonamide Openeye Name: (8S,11S,13S,17S)-8-ethyl-11-hexyl-17-hydroxy-13-methyl-7,9,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthrene-3-sulfonamide CAS Name: (8S,11S,13S,17S)-8-ethyl-11-hexyl-17-hydroxy-13-methyl-7,9,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthrene-3-sulfonamide IUPAC Name: (8S,11S,13S,17S)-8-ethyl-11-hexyl-17-hydroxy-13-methyl-7,9,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthrene-3-sulfonamide Traditional Name: (8S,11S,13S,17S)-8-ethyl-11-hexyl-17-hydroxy-13-methyl-7,9,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthrene-3-sulfonamide Formula: C26H41NO3S MolecularWeight: 447.67364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC2(C(CCC2O)C3(C1C4=C(CC3)C=C(C=C4)S(=O)(=O)N)CC)C

Isomeric SMILES

CCCCCC[C@H]1C[C@@]2([C@H](CCC2[C@]3(C1C4=C(CC3)C=C(C=C4)S(=O)(=O)N)CC)O)C

InChI

InChI=1S/C26H41NO3S/c1-4-6-7-8-9-19-17-25(3)22(12-13-23(25)28)26(5-2)15-14-18-16-20(31(27,29)30)10-11-21(18)24(19)26/h10-11,16,19,22-24,28H,4-9,12-15,17H2,1-3H3,(H2,27,29,30)/t19-,22?,23-,24?,25-,26-/m0/s1