Basic information
- Standard SMILES
COC(=O)[C@@H](N)CS(=O)(=O)O- InChIKey
ATJKKHLWQIDEMZ-VKHMYHEASA-N- Molecular formula
- C4H9NO5S
- Average molar mass
- 183.19 g/mol
Names & identifiers
- Preferred name
- Methyl l-cysteate
- IUPAC
- (2R)-2-amino-3-methoxy-3-oxopropane-1-sulfonic acid
Names & synonyms
methyl l-cysteateL-cysteic Acid Methyl EsterSCHEMBL1786590ATJKKHLWQIDEMZ-VKHMYHEASA-N
Database identifiers
- PubChem CID
- 53661213
Properties
Computed structural properties
- XLogP
- -4.2
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 227
Related reactions
1 records
Compound notes
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