Basic information
- CAS
571-41-5- Standard SMILES
CC12CCC(=O)C=C1CCC1C2CCC2(C)C(O)CCC12- InChIKey
MUMGGOZAMZWBJJ-UHFFFAOYSA-N- Molecular formula
- C19H28O2
- Average molar mass
- 288.4 g/mol
Overview
17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one is a 3-hydroxy steroid. It has a role as an androgen.
Names & identifiers
- Preferred name
- 17-Hydroxy-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta(A)Phenanthren-3-One
- IUPAC
- 17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Names & synonyms
17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one17-Hydroxy-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta(A)Phenanthren-3-OneRefChem:105761617-Hydroxyandrost-4-en-3-one1221910-14-0Oreton F(9beta,10alpha)-17beta-Hydroxyandrost-4-en-3-one4-ANDROSTEN-17A-OL-3-ONE-2,2,4,6,6-D5Neo-Hombreol FAndrost-4-en-17.beta.-ol-3-one17.beta.-Hydroxy-4-androsten-3-one17.beta.-Hydroxyandrost-4-en-3-one
Show more names
.DELTA.4-Androsten-17.beta.-ol-3-oneAndrost-4-en-3-one, 17.beta.-hydroxy-17-Hydroxy-(17.beta.)-androst-4-en-3-oneCHEMBL3866304-Androsten-17?-ol-3-one-2,2,4,6,6-d5CPD000109709Androst-4-en-3-one, 17-hydroxy-, (17.beta.)-Cambridge id 7215855
Database identifiers
- CAS
571-41-5、58-22-0- PubChem CID
- 5408
- ChEMBL
CHEMBL268313- ChEBI
CHEBI:94444
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 508
Experimental & physicochemical properties
DrugsPharmaceuticals
Related reactions
8 records
Compound notes
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