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CHEBI:75278 - N-acetyl-D-glucosaminitol

ChEBI IDCHEBI:75278
ChEBI NameN-acetyl-D-glucosaminitol
Stars
ASCII NameN-acetyl-D-glucosaminitol
DefinitionA 2-deoxyhexitol derivative that is D-glucitol in which the 2-hydroxy substituent is replaced by an acetamido group.
Last Modified20 April 2021
SubmitterSteve
DownloadsMolfile
FormulaC8H17NO6
Net Charge0
Average Mass223.225
Monoisotopic Mass223.10559
SMILESCC(=O)N[C@@H](CO)[C@@H](O)[C@H](O)[C@H](O)CO
WURCSWURCS=2.0/1,1,0/[h2122h_2*NCC/3=O]/1/
InChIInChI=1S/C8H17NO6/c1-4(12)9-5(2-10)7(14)8(15)6(13)3-11/h5-8,10-11,13-15H,2-3H2,1H3,(H,9,12)/t5-,6+,7+,8+/m0/s1
InChIKeyDWAICOVNOFPYLS-LXGUWJNJSA-N
ChEBI Ontology
Outgoing Relation(s)
N-acetyl-D-glucosaminitol (CHEBI:75278) is a 2-deoxyhexitol derivative (CHEBI:63431)
Incoming Relation(s)
α-D-Manp-(1→2)-α-D-Manp-(1→3)-D-GlcNAc-ol (CHEBI:148221) has functional parent N-acetyl-D-glucosaminitol (CHEBI:75278)
α-L-Fucp-(1→6)-D-Glc-OH (CHEBI:155415) has functional parent N-acetyl-D-glucosaminitol (CHEBI:75278)
β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-D-GlcNAc-OH (CHEBI:147677) has functional parent N-acetyl-D-glucosaminitol (CHEBI:75278)
IUPAC Name 
2-acetamido-2-deoxy-D-glucitol
Synonyms  Source
N-AcetylglucosaminitolChemIDplus
2-Acetamido-2-deoxyglucitolChemIDplus
2-(acetylamino)-2-deoxy-D-glucitolChEBI
Manual XrefsDatabases
CPD-3615MetaCyc
G89565QLGlyTouCan
G89565QLGlyGen
Registry NumbersSources
Reaxys:1727004Reaxys
CAS:4271-28-7ChemIDplus
Citations