5,5,13'-trimethyl-5'-oxidanyl-11'-[4-(1,3-thiazol-2-yl)phenyl]spiro[1,3-dioxane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-one

Systemtic Name: 5,5,13'-trimethyl-5'-oxidanyl-11'-[4-(1,3-thiazol-2-yl)phenyl]spiro[1,3-dioxane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-one Openeye Name: 5'-hydroxy-5,5,13'-trimethyl-11'-(4-thiazol-2-ylphenyl)spiro[1,3-dioxane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-one CAS Name: 5'-hydroxy-5,5,13'-trimethyl-11'-[4-(2-thiazolyl)phenyl]-17'-spiro[1,3-dioxane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]one IUPAC Name: 5'-hydroxy-5,5,13'-trimethyl-11'-[4-(1,3-thiazol-2-yl)phenyl]spiro[1,3-dioxane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-one Traditional Name: 5'-hydroxy-5,5,13'-trimethyl-11'-(4-thiazol-2-ylphenyl)spiro[1,3-dioxane-2,3'-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-one Formula: C32H39NO4S MolecularWeight: 533.72136

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2(CCC3=C4C(CCC3(C2)O)C5CCC(=O)C5(CC4C6=CC=C(C=C6)C7=NC=CS7)C)OC1)C

Isomeric SMILES

CC1(COC2(CCC3=C4C(CCC3(C2)O)C5CCC(=O)C5(CC4C6=CC=C(C=C6)C7=NC=CS7)C)OC1)C

InChI

InChI=1S/C32H39NO4S/c1-29(2)18-36-32(37-19-29)13-11-25-27-22(10-12-31(25,35)17-32)24-8-9-26(34)30(24,3)16-23(27)20-4-6-21(7-5-20)28-33-14-15-38-28/h4-7,14-15,22-24,35H,8-13,16-19H2,1-3H3