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CHEBI:199305 - 5-(3',3'-dimethylallyloxy)-7-hydroxy-6-methylphthalide

ChEBI IDCHEBI:199305
ChEBI Name5-(3',3'-dimethylallyloxy)-7-hydroxy-6-methylphthalide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H16O4
Net Charge0
Average Mass248.278
Monoisotopic Mass248.10486
SMILESCC(C)=CCOc1cc2c(c(O)c1C)C(=O)OC2
InChIInChI=1S/C14H16O4/c1-8(2)4-5-17-11-6-10-7-18-14(16)12(10)13(15)9(11)3/h4,6,15H,5,7H2,1-3H3
InChIKeyOBLRTUOESOIUPD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Albatrellopsis confluens (ncbitaxon:2925186) - PubMed (25465923)
ChEBI Ontology
Outgoing Relation(s)
5-(3',3'-dimethylallyloxy)-7-hydroxy-6-methylphthalide (CHEBI:199305) is a 2-benzofurans (CHEBI:38831)
IUPAC Name 
7-hydroxy-6-methyl-5-(3-methylbut-2-enoxy)-3H-2-benzouran-1-one
Manual XrefsDatabases
78435577ChemSpider