Basic information
- Standard SMILES
N[C@@H](CC(Cc1ccccc1)C(=O)O)C(=O)O- InChIKey
ATCFYQUZTYQTJN-AXDSSHIGSA-N- Molecular formula
- C12H15NO4
- Average molar mass
- 237.25 g/mol
Names & identifiers
- Preferred name
- gamma-benzyl-L-glutamic acid
- IUPAC
- (2S)-2-amino-4-benzylpentanedioic acid
Names & synonyms
gamma-benzyl-L-glutamic acidgamma-benzyl glutamic acidSCHEMBL133913ATCFYQUZTYQTJN-AXDSSHIGSA-NAKOS015995329(2S)-2-amino-4-benzylpentanedioicacid(4S)-4-amino-2-benzylpentanedioic acidDB-179147ST508258593283-43-0
Database identifiers
- PubChem CID
- 22787902
- Nikkaji
- J622.124F
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 274
Related reactions
1 records
Compound notes
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