3,19-Dihydroxypregn-5-en-20-one structure

3,19-Dihydroxypregn-5-en-20-one

1-[3-hydroxy-10-(hydroxymethyl)-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone

Also Known As: 19-Hydroxypregnenolone|3,19-dihydroxypregn-5-en-20-one|NCIOpen2_009410|1-[(8S,9S,10S,13S,14S,17S)-3-hydroxy-10-(hydroxymethyl)-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone|1-[3-hydroxy-10-(hydroxymethyl)-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone

CAS: 4777-62-2
Molecular Formula C21H32O3
Molecular Weight 332.23514 g/mol
LogP 3.0
Topological Polar Surface Area 57.5 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
Rotatable Bonds 2
Exact Mass 332.23514
Monoisotopic Mass 332.23514
Heavy Atoms 24
Complexity 567.0

Chemical Identifiers

CAS Number 4777-62-2
SMILES CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)CO)C
InChIKey OZDXQAGUBNCANU-UHFFFAOYSA-N

Product Overview

3,19-Dihydroxypregn-5-en-20-one (CAS 4777-62-2), with molecular formula C21H32O3 and molecular weight 332.23514 g/mol. IUPAC: 1-[3-hydroxy-10-(hydroxymethyl)-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone.

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