Basic information
- Standard SMILES
CC(=O)Oc1ccccc1C(=O)[O-].CC[C@]12CCCN3CCc4c(n(c5ccccc45)[C@@](O)(C(=O)OC)C1)[C@@H]32- InChIKey
WDOZYJIBDUUYIJ-YAFGAGFVSA-M- Molecular formula
- C30H33N2O7-
- Average molar mass
- 533.6 g/mol
Names & identifiers
- Preferred name
- Vincamine acetylsalicylate
- IUPAC
- 2-acetyloxybenzoate;methyl (15S,17S,19S)-15-ethyl-17-hydroxy-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18)-tetraene-17-carboxylate
Names & synonyms
Vincamine acetylsalicylateWDOZYJIBDUUYIJ-YAFGAGFVSA-M
Database identifiers
- PubChem CID
- 86736089
Properties
Computed structural properties
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 39
- Formal charge
- -1
- Complexity
- 804
Related reactions
1 records
Compound notes
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