Basic information
- Standard SMILES
CC(=O)OC(CSC(C)=O)C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C- InChIKey
YECAVRSJBYALQW-BHWOMJMDSA-N- Molecular formula
- C22H38N2O8S
- Average molar mass
- 490.6 g/mol
Names & identifiers
- Preferred name
- Nalpha-[2-acetoxy-3-(acetylthio)propanoyl]-Nepsilon-tert.butyloxycarbonyl-L-lysine tert.butyl ester
- IUPAC
- tert-butyl (2S)-2-[(2-acetyloxy-3-acetylsulfanylpropanoyl)amino]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate
Names & synonyms
YECAVRSJBYALQW-BHWOMJMDSA-NNalpha -[2-acetoxy-3-(acetylthio)propanoyl]-Nepsilon -tert.butyloxycarbonyl-L-lysine tert.butyl ester
Database identifiers
- PubChem CID
- 86736713
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 162 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 17
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 697
Related reactions
1 records
Compound notes
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