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CHEBI:193528 - 2-(2,6-dihydroxy-3,4-dimethoxycyclohexylidene)acetonitrile

ChEBI IDCHEBI:193528
ChEBI Name2-(2,6-dihydroxy-3,4-dimethoxycyclohexylidene)acetonitrile
Stars
Submittermwilliams
DownloadsMolfile
FormulaC10H15NO4
Net Charge0
Average Mass213.233
Monoisotopic Mass213.10011
SMILESCOC1CC(O)/C(=C/C#N)C(O)C1OC
InChIInChI=1S/C10H15NO4/c1-14-8-5-7(12)6(3-4-11)9(13)10(8)15-2/h3,7-10,12-13H,5H2,1-2H3/b6-3-
InChIKeyBMULURCIZGUYIM-UTCJRWHESA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
2-(2,6-dihydroxy-3,4-dimethoxycyclohexylidene)acetonitrile (CHEBI:193528) is a cyclitol (CHEBI:23451)
2-(2,6-dihydroxy-3,4-dimethoxycyclohexylidene)acetonitrile (CHEBI:193528) is a nitrile (CHEBI:18379)