5-[(10,13-dimethyl-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-methyl-amino]-3-fluoranyl-2-methyl-pentanoic acid

Systemtic Name: 5-[(10,13-dimethyl-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-methyl-amino]-3-fluoranyl-2-methyl-pentanoic acid Openeye Name: 3-fluoro-5-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-methyl-amino]-2-methyl-pentanoic acid CAS Name: 3-fluoro-5-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-methylamino]-2-methylpentanoic acid IUPAC Name: 3-fluoro-5-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-methylamino]-2-methylpentanoic acid Traditional Name: 3-fluoro-5-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-methyl-amino]-2-methyl-valeric acid Formula: C26H42FNO3 MolecularWeight: 435.614983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCN(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)F)C(=O)O

Isomeric SMILES

CC(C(CCN(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)F)C(=O)O

InChI

InChI=1S/C26H42FNO3/c1-16(24(30)31)22(27)11-14-28(4)23-8-7-20-19-6-5-17-15-18(29)9-12-25(17,2)21(19)10-13-26(20,23)3/h5,16,18-23,29H,6-15H2,1-4H3,(H,30,31)