Basic information
- CAS
72722-25-9- Standard SMILES
CC(O)C(NC(=O)OCc1ccccc1)C(=O)NCC(=O)NCC(=O)OCc1ccccc1- InChIKey
APVJFYNVCWMAEC-UHFFFAOYSA-N- Molecular formula
- C23H27N3O7
- Average molar mass
- 457.5 g/mol
- Monoisotopic mass
- 457.18490021
Names & identifiers
- Preferred name
- Benzyl 2-[[2-[[3-hydroxy-2-(phenylmethoxycarbonylamino)butanoyl]amino]acetyl]amino]acetate
- IUPAC
- benzyl 2-[[2-[[3-hydroxy-2-(phenylmethoxycarbonylamino)butanoyl]amino]acetyl]amino]acetate
Names & synonyms
NSC343730MLS00317100272722-25-9DTXSID60319322NSC-343730SMR001874913Benzyl N-[(benzyloxy)carbonyl]threonylglycylglycinate
Database identifiers
- CAS
72722-25-9- PubChem CID
- 335264
- DTXSID
DTXSID60319322
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 13
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 646
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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