Basic information
- CAS
156857-10-2- Standard SMILES
O=C1N[C@@H](CO)[C@H](O)[C@@H](O)[C@H]1O- InChIKey
AJJXPYDGVXIEHE-QMKXCQHVSA-N- Molecular formula
- C6H11NO5
- Average molar mass
- 177.16 g/mol
- Monoisotopic mass
- 177.06372245
Names & identifiers
- Preferred name
- L-Mannonic-1,5-lactam
- IUPAC
- (3R,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)piperidin-2-one
Names & synonyms
L-Mannonic-1,5-lactam156857-10-2(3R,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)piperidin-2-one2-Piperidinone, 3,4,5-trihydroxy-6-(hydroxymethyl)-, (3alpha,4alpha,5beta,6alpha)-DTXSID301661432-Piperidinone, 3,4,5-trihydroxy-6-(hydroxymethyl)-, (3a,4a,5b,6a)-
Database identifiers
- CAS
156857-10-2- PubChem CID
- 452003
- DTXSID
DTXSID30166143
Properties
Computed structural properties
- XLogP
- -2.6
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 185
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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