Basic information
- CAS
76626-36-3- Standard SMILES
CC(C)[C@@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(=O)[C@H](CCCCN)Nc1ccc([N+](=O)[O-])cc1- InChIKey
ORXWLYZHKCZVIC-RJGXRXQPSA-N- Molecular formula
- C26H36N6O5
- Average molar mass
- 512.6 g/mol
- Monoisotopic mass
- 512.27471827
Names & identifiers
- Preferred name
- Valyl-phenylalanyl-lysine-4-nitroanilide
- IUPAC
- (2S)-6-amino-N-[(2S)-2-[[(2R)-2-amino-3-methylbutanoyl]amino]-3-phenylpropanoyl]-2-(4-nitroanilino)hexanamide
- English name
- valyl-phenylalanyl-lysine-4-nitroanilide
- Molecular weight
- 0
Names & synonyms
Valyl-phenylalanyl-lysine-4-nitroanilideVal-phe-lys-pna76626-36-3S-2390L-Lysinamide, D-valyl-L-phenylalanyl-N-(4-nitrophenyl)-RefChem:193632(2S)-6-amino-N-[(2S)-2-[[(2R)-2-amino-3-methylbutanoyl]amino]-3-phenylpropanoyl]-2-(4-nitroanilino)hexanamideH-D-Val-phe-lys-p-nitroanilideSCHEMBL29512267DTXSID70997958H-D-Valyl-L-phenylalanyl-L-lysine-p-nitroanilide dihydrochloride(2S)-6-Amino-N-{N-[(2R)-2-amino-1-hydroxy-3-methylbutylidene]-L-phenylalanyl}-2-(4-nitroanilino)hexanimidic acid
Show more names
6-Amino-N-[N-(2-amino-1-hydroxy-3-methylbutylidene)phenylalanyl]-2-(4-nitroanilino)hexanimidic acid
Database identifiers
- CAS
76626-36-3- PubChem CID
- 192089
- DTXSID
DTXSID70997958
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 185 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 13
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 744
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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