Basic information
- Standard SMILES
CNCCc1ccc(O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]2O)cc1- InChIKey
GSFPZJQNMMHOQO-BGJHODNPSA-N- Molecular formula
- C15H23NO5
- Average molar mass
- 297.35 g/mol
- Monoisotopic mass
- 297.15762284
Names & identifiers
- Preferred name
- (2S,3S,4R,5R,6S)-2-methyl-6-[4-[2-(methylamino)ethyl]phenoxy]oxane-3,4,5-triol
- IUPAC
- (2S,3S,4R,5R,6S)-2-methyl-6-[4-[2-(methylamino)ethyl]phenoxy]oxane-3,4,5-triol
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 91.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 308
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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