Basic information
- CAS
921933-89-3- Standard SMILES
C[C@@H](N)C(=O)N[C@@H](COC(=O)c1cccnc1)C(=O)O- InChIKey
HNDYIUZYTYHFAP-APPZFPTMSA-N- Molecular formula
- C12H15N3O5
- Average molar mass
- 281.26 g/mol
- Monoisotopic mass
- 281.10117059
Names & identifiers
- Preferred name
- D-Alanyl-O-(pyridine-3-carbonyl)-L-serine
- IUPAC
- (2S)-2-[[(2R)-2-aminopropanoyl]amino]-3-(pyridine-3-carbonyloxy)propanoic acid
Names & synonyms
921933-89-3D-Alanyl-O-(pyridine-3-carbonyl)-L-serineDTXSID50840953
Database identifiers
- CAS
921933-89-3- PubChem CID
- 71421908
- DTXSID
DTXSID50840953
Properties
Computed structural properties
- XLogP
- -3.1
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 374
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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