Basic information
- CAS
98843-24-4- Standard SMILES
Br.CN1CC[C@]23c4c5ccc(O)c4O[C@H]2CCC[C@H]3[C@H]1C5- InChIKey
UPRPKOILRMPPHZ-OJSAFBOZSA-N- Molecular formula
- C17H22BrNO2
- Average molar mass
- 352.3 g/mol
- Monoisotopic mass
- 351.08339
Names & identifiers
- Preferred name
- Desomorphine hydrobromide
- IUPAC
- (4R,4aR,7aS,12bS)-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-ol;hydrobromide
Names & synonyms
Desomorphine hydrobromide9N7P66M943Morphine, 6-deoxydihydro-, hydrobromideUNII-9N7P66M94398843-24-4Morphinan-3-ol, 4,5-epoxy-17-methyl-, hydrobromide (1:1), (5alpha)-MORPHINAN-3-OL, 4,5-EPOXY-17-METHYL-, HYDROBROMIDE (1:1), (5.ALPHA.)-
Database identifiers
- CAS
98843-24-4- PubChem CID
- 162368356
- UNII
- 9N7P66M943
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 427
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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