Androstan-17-one, 3-amino-2-hydroxy-, hydrochloride, (2beta,3alpha,5alpha)-
Basic information
- CAS
51740-76-2- Standard SMILES
C[C@]12C[C@H](O)[C@@H]([NH3+])C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12.[Cl-]- InChIKey
NDDAQHROMJDMKS-XFYXLWKMSA-N- Molecular formula
- C19H32ClNO2
- Average molar mass
- 341.9 g/mol
- Monoisotopic mass
- 341.212157
Names & identifiers
- Preferred name
- Androstan-17-one, 3-amino-2-hydroxy-, hydrochloride, (2beta,3alpha,5alpha)-
- IUPAC
- [(2S,3S,5S,8R,9S,10S,13S,14S)-2-hydroxy-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]azanium chloride
Names & synonyms
51740-76-2RefChem:1076988Androstan-17-one, 3-amino-2-hydroxy-, hydrochloride, (2beta,3alpha,5alpha)-AminosteroidAulutonAuluton hydrochlorideORG 60013-alpha-Amino-5-alpha-androstan-2-beta-ol-17-one hydrochlorideANDROSTAN-17-ONE, 3-AMINO-2-HYDROXY-, HYDROCHLORIDE, (2-beta,3-alpha,5-alpha)-[(2S,3S,5S,8R,9S,10S,13S,14S)-2-hydroxy-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]azanium;chlorideNS00124742
Database identifiers
- CAS
51740-76-2- PubChem CID
- 40111
Properties
Computed structural properties
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 492
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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