Basic information
- Standard SMILES
CSCCC(NCC(O)C(O)C(O)C(O)CO)C(=O)O- InChIKey
HMYXDJQTCLLFFK-UHFFFAOYSA-N- Molecular formula
- C11H23NO7S
- Average molar mass
- 313.37 g/mol
Names & identifiers
- Preferred name
- N-(2,3,4,5,6-pentahydroxy-hexyl)-DL-methionine
- IUPAC
- 4-methylsulfanyl-2-(2,3,4,5,6-pentahydroxyhexylamino)butanoic acid
Names & synonyms
SCHEMBL11734201HMYXDJQTCLLFFK-UHFFFAOYSA-NN-(2,3,4,5,6-pentahydroxy-hexyl)-DL-methionine
Database identifiers
- PubChem CID
- 9883282
Properties
Computed structural properties
- XLogP
- -5
- Topological polar surface area
- 176 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 11
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 281
Related reactions
2 records
Compound notes
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