Basic information
- Standard SMILES
CC(=O)OC1C=CC2C3Cc4ccc(O[Si](C)(C)C)c5c4C2(CCN3C)C1O5- InChIKey
HBWAMRSFAPVOKZ-UHFFFAOYSA-N- Molecular formula
- C22H29NO4Si
- Average molar mass
- 399.6 g/mol
- Monoisotopic mass
- 399.18658494
Names & identifiers
- Preferred name
- O6-Acetylmorphine TMS Derivative
- IUPAC
- (3-methyl-9-trimethylsilyloxy-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl) acetate
Names & synonyms
O6-Acetylmorphine TMS DerivativeO6-Acetylmorphin, TMS derivativeO6-Monoacetylmorphine TMS DerivativeRefChem:366590HBWAMRSFAPVOKZ-UHFFFAOYSA-NDTXSID001345039
Database identifiers
- PubChem CID
- 633992
- DTXSID
DTXSID001345039
Properties
Computed structural properties
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 691
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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