2-Deoxy-2-[(1-hydroxybutylidene)amino]hexopyranose
Basic information
- CAS
15961-60-1- Standard SMILES
CCCC(=O)NC1C(O)OC(CO)C(O)C1O- InChIKey
RPJMPMDUKSRLLF-UHFFFAOYSA-N- Molecular formula
- C10H19NO6
- Average molar mass
- 249.26 g/mol
- Monoisotopic mass
- 249.12123733
Names & identifiers
- Preferred name
- 2-Deoxy-2-[(1-hydroxybutylidene)amino]hexopyranose
- IUPAC
- N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]butanamide
Names & synonyms
15961-60-1Oprea1_0994342-Deoxy-2-[(1-hydroxybutylidene)amino]hexopyranoseSCHEMBL5158214DTXSID40936137NSC20599NSC-20599SB48041N-[2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]butanamide
Database identifiers
- CAS
15961-60-1- PubChem CID
- 228030
- DTXSID
DTXSID40936137
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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