Basic information
- CAS
19669-37-5- Standard SMILES
O=C(O)C(Cc1ccc(O)cc1)NC(=O)C1CCCN1C(=O)OCc1ccccc1- InChIKey
QQCLTISFJWQWFL-UHFFFAOYSA-N- Molecular formula
- C22H24N2O6
- Average molar mass
- 412.4 g/mol
- Monoisotopic mass
- 412.16343649
Names & identifiers
- Preferred name
- 1-[(Benzyloxy)carbonyl]prolyltyrosine
- IUPAC
- 3-(4-hydroxyphenyl)-2-[(1-phenylmethoxycarbonylpyrrolidine-2-carbonyl)amino]propanoic acid
Names & synonyms
19669-37-5NSC3341821-[(Benzyloxy)carbonyl]prolyltyrosineDTXSID30318706NSC-3341823-(4-hydroxyphenyl)-2-[(1-phenylmethoxycarbonylpyrrolidine-2-carbonyl)amino]propanoic acidDS-001010
Database identifiers
- CAS
19669-37-5- PubChem CID
- 333394
- DTXSID
DTXSID30318706
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 598
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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