Morphinan-3-ol, 17-(2-(1-pipecolin-4-yl)ethyl)-, sulfate, (-)-
Basic information
- CAS
63868-26-8- Standard SMILES
CN1CCC(CCN2CC[C@]34CCCC[C@H]3[C@H]2Cc2ccc(O)cc24)CC1.O=S(=O)(O)O- InChIKey
VUXURAAEUBMRKC-YGICXTQQSA-N- Molecular formula
- C24H38N2O5S
- Average molar mass
- 466.6 g/mol
- Monoisotopic mass
- 466.25014349
Names & identifiers
- Preferred name
- Morphinan-3-ol, 17-(2-(1-pipecolin-4-yl)ethyl)-, sulfate, (-)-
- IUPAC
- (1R,9R,10R)-17-[2-(1-methylpiperidin-4-yl)ethyl]-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol;sulfuric acid
Names & synonyms
(-)-17-(2-(1-Pipecolin-4-yl)ethyl)morphinan-3-ol sulfate63868-26-8Morphinan-3-ol, 17-(2-(1-pipecolin-4-yl)ethyl)-, sulfate, (-)-RefChem:357414DTXSID70980567Sulfuric acid--17-[2-(1-methylpiperidin-4-yl)ethyl]morphinan-3-ol (1/1)
Database identifiers
- CAS
63868-26-8- PubChem CID
- 5745779
- DTXSID
DTXSID70980567
Properties
Computed structural properties
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 598
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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