3-(6-fluoranyl-10,13-dimethyl-3-oxidanylidene-17-propan-2-yloxycarbonyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid

Systemtic Name: 3-(6-fluoranyl-10,13-dimethyl-3-oxidanylidene-17-propan-2-yloxycarbonyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid Openeye Name: 3-(6-fluoro-17-isopropoxycarbonyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid CAS Name: 3-[6-fluoro-10,13-dimethyl-3-oxo-17-[oxo(propan-2-yloxy)methyl]-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]propanoic acid IUPAC Name: 3-(6-fluoro-10,13-dimethyl-3-oxo-17-propan-2-yloxycarbonyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid Traditional Name: 3-(6-fluoro-17-isopropoxycarbonyl-3-keto-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)propionic acid Formula: C26H37FO5 MolecularWeight: 448.567383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1(CCC2C1(CCC3C2CC(C4=CC(=O)CCC34C)F)C)CCC(=O)O

Isomeric SMILES

CC(C)OC(=O)C1(CCC2C1(CCC3C2CC(C4=CC(=O)CCC34C)F)C)CCC(=O)O

InChI

InChI=1S/C26H37FO5/c1-15(2)32-23(31)26(12-8-22(29)30)11-7-19-17-14-21(27)20-13-16(28)5-9-24(20,3)18(17)6-10-25(19,26)4/h13,15,17-19,21H,5-12,14H2,1-4H3,(H,29,30)