Basic information
- CAS
6947-41-7- Standard SMILES
C[C@]12CC[C@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)OCCC[C@@H]12- InChIKey
VNPJDUYJTSUJJA-JUKXBMAYSA-N- Molecular formula
- C19H32O2
- Average molar mass
- 292.5 g/mol
- Monoisotopic mass
- 292.24023026
Overview
D-Homo-17a-oxa-5alpha-androstan-3beta-ol is an organic heterotricyclic compound and an organooxygen compound.
Names & identifiers
- Preferred name
- D-Homo-17a-oxa-5alpha-androstan-3beta-ol
- IUPAC
- (4aS,4bR,6aS,8S,10aS,10bS,12aS)-10a,12a-dimethyl-3,4,4a,4b,5,6,6a,7,8,9,10,10b,11,12-tetradecahydro-2H-naphtho[2,1-f]chromen-8-ol
Names & synonyms
D-Homo-17a-oxa-5alpha-androstan-3beta-ol6947-41-7(4as,4br,6as,8s,10as,10bs,12as)-10a,12a-dimethylhexadecahydro-2h-naphtho[2,1-f]chromen-8-ol(4aS,4bR,6aS,8S,10aS,10bS,12aS)-10a,12a-dimethyl-hexadecahydro-2H-phenanthro[2,1-b]pyran-8-olCHEBI:79499NSC56949NSC-56949(4aS,4bR,6aS,8S,10aS,10bS,12aS)-10a,12a-dimethyl-3,4,4a,4b,5,6,6a,7,8,9,10,10b,11,12-tetradecahydro-2H-naphtho[2,1-f]chromen-8-olQ27148582
Database identifiers
- CAS
6947-41-7- PubChem CID
- 245230
- ChEBI
CHEBI:79499- Nikkaji
- J2.791.425J
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 408
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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