Basic information
- CAS
824952-03-6- Standard SMILES
C[C@@H](O)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O- InChIKey
BDSMSZGEUDBODO-UVHNVNHPSA-N- Molecular formula
- C36H42N6O10
- Average molar mass
- 718.8 g/mol
- Monoisotopic mass
- 718.29624156
Names & identifiers
- Preferred name
- L-Tyrosyl-L-threonyl-L-tryptophyl-L-seryl-L-tyrosine
- IUPAC
- (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
Names & synonyms
824952-03-6L-Tyrosyl-L-threonyl-L-tryptophyl-L-seryl-L-tyrosineDTXSID30837684
Database identifiers
- CAS
824952-03-6- PubChem CID
- 71418366
- DTXSID
DTXSID30837684
Properties
Computed structural properties
- XLogP
- -2.3
- Topological polar surface area
- 276 Ų
- Hydrogen bond donors
- 11
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 17
- Heavy atoms
- 52
- Formal charge
- 0
- Complexity
- 1,210
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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