Basic information
- CAS
152473-70-6- Standard SMILES
CO[C@H]1[C@H](O)[C@H](NC(C)=O)[C@H](C)O[C@H]1O- InChIKey
QNVNPQBAPQNAJC-UQOMZCPUSA-N- Molecular formula
- C9H17NO5
- Average molar mass
- 219.23 g/mol
- Monoisotopic mass
- 219.11067264
Overview
structure given in first source; the terminal sugar of serovar 25 glycopeptidolipid antigen
Names & identifiers
- Preferred name
- 4-Acetamido-4,6-dideoxy-2-O-methylgalactose
- IUPAC
- N-[(2S,3S,4R,5S,6R)-4,6-dihydroxy-5-methoxy-2-methyloxan-3-yl]acetamide
- English name
- 4-acetamido-4,6-dideoxy-2-O-methylgalactose
- Molecular formula
- C9H17NO5
- Molecular weight
- 219.24
Names & synonyms
Adme-galactose4-Acetamido-4,6-dideoxy-2-O-methylgalactose152473-70-6RefChem:97600GlyTouCan:G18538SKG18538SKN-[(2S,3S,4R,5S,6R)-4,6-dihydroxy-5-methoxy-2-methyloxan-3-yl]acetamideDTXSID109345094,6-Dideoxy-4-[(1-hydroxyethylidene)amino]-2-O-methylhexopyranose4,6-Dideoxy-4-[(1-hydroxyethylidene)amino]-2-O-methyl-alpha-L-galactopyranoseα-D-Galactopyranose, 4-(acetylamino)-4,6-dideoxy-2-O-methyl- (9CI)
Database identifiers
- CAS
152473-70-6- PubChem CID
- 197628
- DTXSID
DTXSID10934509
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 88 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 235
Physicochemical properties
- Boiling point
- 478.5 · 478.5±45.0 °C(Predicted)
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- pka
- 12.11 · 12.11±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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