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CHEBI:30999 - levoglucosenone

ChEBI IDCHEBI:30999
ChEBI Namelevoglucosenone
Stars
Last Modified6 August 2008
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC6H6O3
Net Charge0
Average Mass126.111
Monoisotopic Mass126.03169
SMILESO=C1C=C[C@H]2CO[C@@H]1O2
InChIInChI=1S/C6H6O3/c7-5-2-1-4-3-8-6(5)9-4/h1-2,4,6H,3H2/t4-,6+/m0/s1
InChIKeyHITOXZPZGPXYHY-UJURSFKZSA-N
ChEBI Ontology
Outgoing Relation(s)
levoglucosenone (CHEBI:30999) is a anhydrohexose (CHEBI:22557)
levoglucosenone (CHEBI:30999) is a deoxyketohexose (CHEBI:24965)
IUPAC Names 
1,6-anhydro-3,4-dideoxy-β-D-glycero-hex-3-enopyranos-2-ulose
(1S,5R)-6,8-dioxabicyclo[3.2.1]oct-2-en-4-one
Synonym  Source
(1S)-6,8-Dioxabicyclo(3.2.1)oct-2-en-4-oneChemIDplus
Manual XrefsDatabases
US5041566Patent
Registry NumbersSources
CAS:37112-31-5ChemIDplus