Phenylalanyl-alanyl-lysine
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Basic information
- CAS
107889-42-9- Standard SMILES
C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O- InChIKey
ULECEJGNDHWSKD-QEJZJMRPSA-N- Molecular formula
- C18H28N4O4
- Average molar mass
- 364.4 g/mol
- Monoisotopic mass
- 364.21105539
Overview
Phe-Ala-Lys is a tripeptide.
Names & identifiers
- Preferred name
- Phenylalanyl-alanyl-lysine
- IUPAC
- (2S)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]propanoyl]amino]hexanoic acid
- English name
- (2S)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]propan oyl]amino]hexanoic acid
- Molecular formula
- C18H28N4O4
- Molecular weight
- 364.44
Names & synonyms
Phe-ala-lysPhenylalanyl-alanyl-lysine107889-42-9L-Phenylalanyl-L-alanyl-L-lysineDTXSID20148317RefChem:173010DTXCID1070808(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]propanoyl]amino]hexanoic acidCHEMBL1271522SCHEMBL29350734CHEBI:161262(2S)-6-AMINO-2-[[(2S)-2-[[(2S)-2-AMINO-3-PHENYL-PROPANOYL]AMINO]PROPAN OYL]AMINO]HEXANOIC ACID
Show more names
L-Lysine, L-phenylalanyl-L-alanyl-
Database identifiers
- CAS
107889-42-9- PubChem CID
- 5487956
- DTXSID
DTXSID20148317- ChEMBL
CHEMBL1271522- ChEBI
CHEBI:161262
Properties
Computed structural propertiesFilling in
- XLogP
- -3.4
- Topological polar surface area
- 148 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 466
Physicochemical properties
- Boiling point
- 697.4 · 697.4±55.0 °C(Predicted)
- Density
- 1.205 · 1.205±0.06 g/cm3(Predicted)
- pka
- 3.29 · 3.29±0.10(Predicted)
Chemistry & industry
Additional notes
DefinitionChEBI: Phe-Ala-Lys is an oligopeptide.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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