Basic information
- Standard SMILES
COC(=O)[C@@H]1CCCN1C(=O)CN(C)C(=O)[C@H](CCCC(N)C(=O)OCc1ccccc1)NC(=O)CNC(=O)OC(C)(C)C- InChIKey
BBIAOCLWQOHZGE-KXNJDZORSA-N- Molecular formula
- C30H45N5O9
- Average molar mass
- 619.7 g/mol
- Monoisotopic mass
- 619.32172803
Names & identifiers
- Preferred name
- tertiary butyloxycarbonylglycyl-epsilon-benzyloxycarbonyl-L-lysyl-sarcosyl-L-proline methyl ester
- IUPAC
- methyl (2S)-1-[2-[[(2S)-6-amino-2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]-7-oxo-7-phenylmethoxyheptanoyl]-methylamino]acetyl]pyrrolidine-2-carboxylate
Names & synonyms
BBIAOCLWQOHZGE-KXNJDZORSA-Ntertiary butyloxycarbonylglycyl-epsilon-benzyloxycarbonyl-L-lysyl-sarcosyl-L-proline methyl ester
Database identifiers
- PubChem CID
- 86741545
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 187 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 18
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 1,010
Related reactions
1 records
Compound notes
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