EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:193750 - 2-(hydroxymethyl)-5-methoxy-4-methylbenzene-1,3-diol

ChEBI IDCHEBI:193750
ChEBI Name2-(hydroxymethyl)-5-methoxy-4-methylbenzene-1,3-diol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H12O4
Net Charge0
Average Mass184.191
Monoisotopic Mass184.07356
SMILESCOc1cc(O)c(CO)c(O)c1C
InChIInChI=1S/C9H12O4/c1-5-8(13-2)3-7(11)6(4-10)9(5)12/h3,10-12H,4H2,1-2H3
InChIKeyCXACLBZDTNUOHN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
synthetic microbial community (ncbitaxon:3229850) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3129)
ChEBI Ontology
Outgoing Relation(s)
2-(hydroxymethyl)-5-methoxy-4-methylbenzene-1,3-diol (CHEBI:193750) is a methoxybenzenes (CHEBI:51683)
2-(hydroxymethyl)-5-methoxy-4-methylbenzene-1,3-diol (CHEBI:193750) is a phenols (CHEBI:33853)
IUPAC Name 
2-(hydroxymethyl)-5-methoxy-4-methylbenzene-1,3-diol
Manual XrefsDatabases
74851954ChemSpider