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CHEBI:181263 - Allitol

Default Structure
ChEBI IDCHEBI:181263
ChEBI NameAllitol
Stars
Last Modified17 August 2022
SubmitterMetaboLights
DownloadsMolfile
FormulaC6H14O6
Net Charge0
Average Mass182.172
Monoisotopic Mass182.07904
SMILESOC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO
WURCSWURCS=2.0/1,1,0/[h2222h]/1/
InChIInChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4+,5-,6+
InChIKeyFBPFZTCFMRRESA-FBXFSONDSA-N
ChEBI Ontology
Outgoing Relation(s)
Allitol (CHEBI:181263) is a hexitol (CHEBI:24583)
IUPAC Name 
(2R,3R,4S,5S)-hexane-1,2,3,4,5,6-hexol
Manual XrefsDatabases
107748ChemSpider
X9XPDBeChem
Registry NumbersSources
CAS:488-44-8ChemIDplus