Basic information
- CAS
16295-91-3- Standard SMILES
O=C(CNC(=O)OCc1ccccc1)NC(CO)C(=O)NCC(=O)Oc1ccc([N+](=O)[O-])cc1- InChIKey
IZFSOYJVWFRIMM-UHFFFAOYSA-N- Molecular formula
- C21H22N4O9
- Average molar mass
- 474.4 g/mol
- Monoisotopic mass
- 474.13867829
Names & identifiers
- Preferred name
- 4-Nitrophenyl n-[(benzyloxy)carbonyl]glycylserylglycinate
- IUPAC
- (4-nitrophenyl) 2-[[3-hydroxy-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoyl]amino]acetate
Names & synonyms
16295-91-3NSC1184764-nitrophenyl n-[(benzyloxy)carbonyl]glycylserylglycinateDTXSID70297849NSC-118476
Database identifiers
- CAS
16295-91-3- PubChem CID
- 273333
- DTXSID
DTXSID70297849
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 189 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 12
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 714
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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