Products 91935-26-1

CAS 91935-26-1 is the registry number for Toripristone. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

(8S,11R,13S,14S,17S)-17-hydroxy-13-methyl-11-[4-[methyl(propan-2-yl)amino]phenyl]-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one (CAS 91935-26-1) is a chemical compound with the molecular formula C31H39NO2 and a molecular weight of 457.6 g/mol. IUPAC name: (8S,11R,13S,14S,17S)-17-hydroxy-13-methyl-11-[4-[methyl(propan-2-yl)amino]phenyl]-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one. InChIKey: LOIYXTZQBQVHSF-PABOLRIOSA-N.

Identity
Molecular formulaC31H39NO2
Molecular weight457.6 g/mol
IUPAC name(8S,11R,13S,14S,17S)-17-hydroxy-13-methyl-11-[4-[methyl(propan-2-yl)amino]phenyl]-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
InChIKeyLOIYXTZQBQVHSF-PABOLRIOSA-N
SMILESCC#C[C@@]1(CC[C@@H]2[C@@]1(C[C@@H](C3=C4CCC(=O)C=C4CC[C@@H]23)C5=CC=C(C=C5)N(C)C(C)C)C)O

Computed by PubChem (NCBI)