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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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ChEBI Name 2-[(3,3-dimethyloxiran-2-yl)methyl]-5-methoxybenzene-1,3-diol
ChEBI ID CHEBI:194009
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H16O4
Net Charge 0
Average Mass 224.256
Monoisotopic Mass 224.10486
InChI InChI=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
InChIKey LEZDSBKQXYSASH-UHFFFAOYSA-N
SMILES O1C(C1CC2=C(O)C=C(OC)C=C2O)(C)C
Metabolite of Species Details
mock community culture Found in Whole Organism (NCIT:C13413). See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xref Database
74851558 ChemSpider
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