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CHEBI:227705 - Methyl seco-fomannoxinate

ChEBI IDCHEBI:227705
ChEBI NameMethyl seco-fomannoxinate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC13H16O4
Net Charge0
Average Mass236.267
Monoisotopic Mass236.10486
SMILESCOC(=O)c1ccc(OC=C(C)C)c(CO)c1
InChIInChI=1S/C13H16O4/c1-9(2)8-17-12-5-4-10(13(15)16-3)6-11(12)7-14/h4-6,8,14H,7H2,1-3H3
InChIKeyOQLLGLMRINQAND-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Methyl seco-fomannoxinate (CHEBI:227705) is a benzoate ester (CHEBI:36054)
IUPAC Name 
methyl 3-(hydroxymethyl)-4-(2-methylprop-1-enoxy)benzoate
Manual XrefsDatabases
76729335ChemSpider