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CHEBI:27987 - muco-inositol

Default Structure
ChEBI IDCHEBI:27987
ChEBI Namemuco-inositol
Stars
ASCII Namemuco-inositol
DefinitionAn inositol that is cyclohexane-1,2,3,4,5,6-hexol having a (1R,2R,3r,4R,5S,6r)-configuration.
Secondary ChEBI IDsCHEBI:10600, CHEBI:25421
Last Modified12 May 2015
DownloadsMolfile
FormulaC6H12O6
Net Charge0
Average Mass180.156
Monoisotopic Mass180.06339
SMILESO[C@H]1[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5+,6+
InChIKeyCDAISMWEOUEBRE-GNIYUCBRSA-N
Roles Classification
Biological Role:
human urinary metabolite  Any metabolite (endogenous or exogenous) found in human urine samples.
ChEBI Ontology
Outgoing Relation(s)
muco-inositol (CHEBI:27987) has role human urinary metabolite (CHEBI:84087)
muco-inositol (CHEBI:27987) is a inositol (CHEBI:24848)
IUPAC Name 
muco-inositol
Synonyms  Source
1,2,4,5/3,6-cyclohexanehexolIUPAC
(1r,2R,3S,4r,5R,6S)-cyclohexane-1,2,3,4,5,6-hexolIUPAC
muco-InositolKEGG COMPOUND
Manual XrefsDatabases
C06152KEGG COMPOUND
Registry NumbersSources
Reaxys:2042262Reaxys
CAS:488-55-1KEGG COMPOUND
CAS:488-55-1ChemIDplus
Citations