alpha-Aspartylphenylalanine
Basic information
- Standard SMILES
NC(CC(=O)O)C(=O)NC(Cc1ccccc1)C(=O)O- InChIKey
YZQCXOFQZKCETR-UHFFFAOYSA-N- Molecular formula
- C13H16N2O5
- Average molar mass
- 280.28 g/mol
- Monoisotopic mass
- 280.10592161
Names & identifiers
- Preferred name
- alpha-Aspartylphenylalanine
- IUPAC
- 3-amino-4-[(1-carboxy-2-phenylethyl)amino]-4-oxobutanoic acid
Names & synonyms
alpha-AspartylphenylalanineDTXSID40864401RefChem:1076447DTXCID408129223.Aspartame acidaspartylphenylalanin.alpha.-L-Asp-L-PheSCHEMBL135367YZQCXOFQZKCETR-UHFFFAOYSA-N.alpha.L-Aspartyl-L-phenylalanineSTL416208AKOS009158725
Show more names
3-amino-4-[(1-carboxy-2-phenyl-ethyl)amino]-4-oxo-butanoic acid
Database identifiers
- PubChem CID
- 3317082
- DTXSID
DTXSID40864401- Nikkaji
- J27.534D
Properties
Computed structural properties
- XLogP
- -3.3
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 366
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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