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CHEBI:15975 - 1D-5-O-methyl-myo-inositol

Default Structure
ChEBI IDCHEBI:15975
ChEBI Name1D-5-O-methyl-myo-inositol
Stars
ASCII Name1D-5-O-methyl-myo-inositol
DefinitionA member of the class of methyl myo-inositols that is cyclohexane-1,2,3,4,5-pentol substituted by a methoxy group at position 6 (the 1R,2S,3r,4R,5S,6r-stereoisomer).
Secondary ChEBI IDsCHEBI:2107, CHEBI:12096, CHEBI:20535
Last Modified13 November 2017
DownloadsMolfile
FormulaC7H14O6
Net Charge0
Average Mass194.183
Monoisotopic Mass194.07904
SMILESCO[C@H]1[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3/t2-,3+,4-,5-,6+,7+
InChIKeyDSCFFEYYQKSRSV-GWJPIIGYSA-N
Species of MetaboliteComponentSourceComments
Amentotaxus yunnanensis (ncbitaxon:89479) - PubMed (12880325)
Melicope micrococca (ncbitaxon:1226092) - DOI (10.1016/S0031-9422(98)00673-6)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
1D-5-O-methyl-myo-inositol (CHEBI:15975) has role plant metabolite (CHEBI:76924)
1D-5-O-methyl-myo-inositol (CHEBI:15975) is a methyl myo-inositols (CHEBI:25270)
IUPAC Name 
1D-5-O-methyl-myo-inositol
Synonyms  Source
1D-5-O-Methyl-myo-inositolKEGG COMPOUND
(1R,2S,3r,4R,5S,6r)-6-methoxycyclohexane-1,2,3,4,5-pentolIUPAC
5-O-Methyl-myo-inositolKEGG COMPOUND
SequoyitolKEGG COMPOUND
UniProt Name  Source
1D-5-O-methyl-myo-inositolUniProt
Manual XrefsDatabases
C00001172KNApSAcK
C03365KEGG COMPOUND
Registry NumbersSources
Reaxys:2043787Reaxys
CAS:523-92-2KEGG COMPOUND
Citations