Basic information
- CAS
63732-88-7- Standard SMILES
COc1ccc(CC(O)N2CC[C@]34CCCC[C@H]3[C@H]2Cc2ccc(O)cc24)cc1.Cl- InChIKey
SFKAGNBDQIEJKL-QKWMYHQSSA-N- Molecular formula
- C25H32ClNO3
- Average molar mass
- 430 g/mol
- Monoisotopic mass
- 429.2070716
Names & identifiers
- Preferred name
- Morphinan-3-ol, 17-(alpha-hydroxy-p-methoxy)phenethyl-, hydrochloride, (-)-
- IUPAC
- (1R,9R,10R)-17-[1-hydroxy-2-(4-methoxyphenyl)ethyl]-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol;hydrochloride
Names & synonyms
Morphinan-3-ol, 17-(2-p-anisyl-2-hydroxy)ethyl-, hydrochloride, (-)-63732-88-7Morphinan-3-ol, 17-(alpha-hydroxy-p-methoxy)phenethyl-, hydrochloride, (-)-RefChem:357430DTXSID3098024017-[1-Hydroxy-2-(4-methoxyphenyl)ethyl]morphinan-3-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
63732-88-7- PubChem CID
- 5486019
- DTXSID
DTXSID30980240
Properties
Computed structural properties
- Topological polar surface area
- 52.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 562
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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