Pregn-4-ene-3,20-dione, 17-hydroxy-6-methyl-
Basic information
- CAS
14423-24-6- Standard SMILES
CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CC(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C- InChIKey
FRQMUZJSZHZSGN-NJMUXRGYSA-N- Molecular formula
- C22H32O3
- Average molar mass
- 344.5 g/mol
- Monoisotopic mass
- 344.23514488
Names & identifiers
- Preferred name
- Pregn-4-ene-3,20-dione, 17-hydroxy-6-methyl-
- IUPAC
- (8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Names & synonyms
14423-24-6NSC 2740817-Hydroxy-6.alpha.-methylprogesteronePregn-4-ene-3,20-dione, 17-hydroxy-6-methyl-Provera (Salt/Mix)Farlutal (Salt/Mix)17.alpha.-Hydroxy-6.alpha.-methylprogesterone6.alpha.-Methyl-17.alpha.-hydroxyprogesteronePregn-4-ene-3,20-dione, 17-hydroxy-6-methyl-, (6.alpha.)-SCHEMBL4877448DTXSID20932273FRQMUZJSZHZSGN-NJMUXRGYSA-N
Show more names
17-Hydroxy-6-methylpregn-4-ene-3,20-dionato17-Hydroxy-6.alpha.-methylpregn-4-en-3,20-dione6.alpha.-Methyl-4-pregnen-17.alpha.-ol-3,20-dionePregn-4-ene-3,20-dione, 17-hydroxy-6.alpha.-methyl-17-Hydroxy-6-methylpregn-4-ene-3,20-dione- (6.alpha., 17.alpha.)- #
Database identifiers
- CAS
14423-24-6- PubChem CID
- 203441
- DTXSID
DTXSID20932273- Nikkaji
- J66.997K
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 664
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Compound notes
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