3alpha-Toluene-p-sulphonyloxy-5alpha-pregnan-20-one

HCID 53885237

Basic information

Standard SMILES: CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](OS(=O)(=O)c5ccc(C)cc5)CC[C@]4(C)[C@H]3CC[C@]12C
InChIKey: HMQZDUPWUUCPPF-BNOLYSMESA-N
Molecular formula: C28H40O4S
Average molar mass: 472.7 g/mol
Monoisotopic mass: 472.26473093

Preferred name: 3alpha-Toluene-p-sulphonyloxy-5alpha-pregnan-20-one
IUPAC: [(3R,5S,8R,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] 4-methylbenzenesulfonate

SCHEMBL8134278HMQZDUPWUUCPPF-BNOLYSMESA-N3alpha-toluene-p-sulphonyloxy-5alpha-pregnan-20-one

4 records

HRID 232793As productuspto-grants-1997_01

HRID 232794As reactantuspto-grants-1997_01

HRID 2253806As productuspto-grants-1993_08

HRID 2253807As reactantuspto-grants-1993_08

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Standard SMILES: CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](OS(=O)(=O)c5ccc(C)cc5)CC[C@]4(C)[C@H]3CC[C@]12C
InChIKey: HMQZDUPWUUCPPF-BNOLYSMESA-N
Molecular formula: C28H40O4S
Average molar mass: 472.7 g/mol
Monoisotopic mass: 472.26473093