L-Tyrosyl-L-glutaminyl-L-tyrosyl-L-glutaminyl-L-tyrosyl-L-glutamine
Basic information
- CAS
827018-99-5- Standard SMILES
NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O- InChIKey
OKMBAOXCEAISPU-FSJACQRISA-N- Molecular formula
- C42H53N9O13
- Average molar mass
- 891.9 g/mol
- Monoisotopic mass
- 891.37628278
Names & identifiers
- Preferred name
- L-Tyrosyl-L-glutaminyl-L-tyrosyl-L-glutaminyl-L-tyrosyl-L-glutamine
- IUPAC
- (2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoic acid
Names & synonyms
827018-99-5DTXSID20837198L-Tyrosyl-L-glutaminyl-L-tyrosyl-L-glutaminyl-L-tyrosyl-L-glutamine
Database identifiers
- CAS
827018-99-5- PubChem CID
- 71417868
- DTXSID
DTXSID20837198
Properties
Computed structural properties
- XLogP
- -5.7
- Topological polar surface area
- 399 Ų
- Hydrogen bond donors
- 13
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 26
- Heavy atoms
- 64
- Formal charge
- 0
- Complexity
- 1,610
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Related reactions
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Compound notes
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