L-Pyroglutamyl-L-phenylalanine Methyl Ester
Basic information
- Standard SMILES
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCC(=O)N1- InChIKey
YKGJSUNBVMJPQI-RYUDHWBXSA-N- Molecular formula
- C15H18N2O4
- Average molar mass
- 290.31 g/mol
Names & identifiers
- Preferred name
- L-Pyroglutamyl-L-phenylalanine Methyl Ester
- IUPAC
- methyl (2S)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]-3-phenylpropanoate
Names & synonyms
SCHEMBL10335315YKGJSUNBVMJPQI-RYUDHWBXSA-NL-Pyroglutamyl-L-phenylalanine Methyl Ester
Database identifiers
- PubChem CID
- 12378871
- Nikkaji
- J1.986.977F
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 404
Related reactions
3 records
Compound notes
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