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CHEBI:194009 - 2-[(3,3-dimethyloxiran-2-yl)methyl]-5-methoxybenzene-1,3-diol

ChEBI IDCHEBI:194009
ChEBI Name2-[(3,3-dimethyloxiran-2-yl)methyl]-5-methoxybenzene-1,3-diol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O4
Net Charge0
Average Mass224.256
Monoisotopic Mass224.10486
SMILESCOc1cc(O)c(CC2OC2(C)C)c(O)c1
InChIInChI=1S/C12H16O4/c1-12(2)11(16-12)6-8-9(13)4-7(15-3)5-10(8)14/h4-5,11,13-14H,6H2,1-3H3
InChIKeyLEZDSBKQXYSASH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
synthetic microbial community (ncbitaxon:3229850) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3129)
ChEBI Ontology
Outgoing Relation(s)
2-[(3,3-dimethyloxiran-2-yl)methyl]-5-methoxybenzene-1,3-diol (CHEBI:194009) is a methoxybenzenes (CHEBI:51683)
2-[(3,3-dimethyloxiran-2-yl)methyl]-5-methoxybenzene-1,3-diol (CHEBI:194009) is a phenols (CHEBI:33853)
IUPAC Name 
2-[(3,3-dimethyloxiran-2-yl)methyl]-5-methoxybenzene-1,3-diol
Manual XrefsDatabases
74851558ChemSpider