EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:16813 - galactitol

ChEBI IDCHEBI:16813
ChEBI Namegalactitol
Stars
DefinitionAn optically inactive hexitol having meso-configuration.
Secondary ChEBI IDsCHEBI:5251, CHEBI:14286, CHEBI:24139, CHEBI:53575
Last Modified15 July 2020
SubmitterSteve
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/[h2112h]/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-GUCUJZIJSA-N

Wikipedia
Species of MetaboliteComponentSourceComments
Sporochnus comosus (ncbitaxon:45367) - PubMed (21348445) MeOH and CH2Cl2 extracts of freeze-dried brown algae
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification

ChEBI Ontology
IUPAC Name 
meso-galactitol
Synonyms  Source
GalactitolKEGG COMPOUND
DulcitolKEGG COMPOUND
DulcoseKEGG COMPOUND
D-DulcitolChemIDplus
D-galactitolChEBI
(2R,3S,4R,5S)-hexane-1,2,3,4,5,6-hexolIUPAC
UniProt Name  Source
galactitolUniProt
Manual XrefsDatabases
C01697KEGG COMPOUND
C01697KEGG COMPOUND
HMDB0000107HMDB
GalactitolWikipedia
C00001160KNApSAcK
Registry NumbersSources
Gmelin:83163Gmelin
Reaxys:1721903Reaxys
CAS:608-66-2KEGG COMPOUND
CAS:608-66-2ChemIDplus
CAS:608-66-2NIST Chemistry WebBook
Citations