L-Histidyl-L-seryl-L-asparaginyl-L-tyrosine
Basic information
- CAS
827017-26-5- Standard SMILES
NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O- InChIKey
KVWINJKLFTUSPH-QAETUUGQSA-N- Molecular formula
- C22H29N7O8
- Average molar mass
- 519.5 g/mol
- Monoisotopic mass
- 519.20776091
Names & identifiers
- Preferred name
- L-Histidyl-L-seryl-L-asparaginyl-L-tyrosine
- IUPAC
- (2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
Names & synonyms
827017-26-5L-Histidyl-L-seryl-L-asparaginyl-L-tyrosineDTXSID30837220
Database identifiers
- CAS
827017-26-5- PubChem CID
- 71417890
- DTXSID
DTXSID30837220
Properties
Computed structural properties
- XLogP
- -5.3
- Topological polar surface area
- 263 Ų
- Hydrogen bond donors
- 9
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 14
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 821
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Related reactions
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Compound notes
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