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CHEBI:73979 - 2-acetamidoglucal

ChEBI IDCHEBI:73979
ChEBI Name2-acetamidoglucal
Stars
DefinitionA glycal derivative that is 1,5-anhydro-2-deoxy-D-arabino-hex-1-enitol substituted by an acetylamino group at position 2.
Last Modified15 August 2023
Submittermwilliams
DownloadsMolfile
FormulaC8H13NO5
Net Charge0
Average Mass203.194
Monoisotopic Mass203.07937
SMILESCC(=O)NC1=CO[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C8H13NO5/c1-4(11)9-5-3-14-6(2-10)8(13)7(5)12/h3,6-8,10,12-13H,2H2,1H3,(H,9,11)/t6-,7-,8-/m1/s1
InChIKeyLKFJQOCOGNNTCY-BWZBUEFSSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
2-acetamidoglucal (CHEBI:73979) has role metabolite (CHEBI:25212)
2-acetamidoglucal (CHEBI:73979) is a acetamides (CHEBI:22160)
2-acetamidoglucal (CHEBI:73979) is a glycal derivative (CHEBI:63380)
IUPAC Name 
2-(acetylamino)-1,5-anhydro-2-deoxy-D-arabino-hex-1-enitol
Synonym  Source
2-acetoamido-1,2-dideoxy-D-arabino-hex-1-enopyranoseChEBI
UniProt Name  Source
2-acetamidoglucalUniProt
Manual XrefsDatabases
CPD-10762MetaCyc
Registry NumbersSources
CAS:10293-59-1ChemIDplus
Citations