Morphinan-3-ol, 17-(m-methoxyphenethyl)-, hydrochloride, (-)-
Basic information
- CAS
63732-95-6- Standard SMILES
COc1cccc(CCN2CC[C@]34CCCC[C@H]3[C@H]2Cc2ccc(O)cc24)c1.Cl- InChIKey
WKBWEUKBTUIKJX-AQFVONAPSA-N- Molecular formula
- C25H32ClNO2
- Average molar mass
- 414 g/mol
- Monoisotopic mass
- 413.212157
Names & identifiers
- Preferred name
- Morphinan-3-ol, 17-(m-methoxyphenethyl)-, hydrochloride, (-)-
- IUPAC
- (1R,9R,10R)-17-[2-(3-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-m-anisylethyl)-, hydrochloride, (-)-63732-95-6Morphinan-3-ol, 17-(m-methoxyphenethyl)-, hydrochloride, (-)-Morphinan-3-ol, 17-(2-(m-methoxyphenyl)ethyl)-, hydrochloride, (-)-RefChem:357432DTXSID5098024717-[2-(3-Methoxyphenyl)ethyl]morphinan-3-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
63732-95-6- PubChem CID
- 5486121
- DTXSID
DTXSID50980247
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 539
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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