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CHEBI:202297 - 5-(2',3'-epoxy-3',3'-dimethylpropoxy)-7-methoxy-6-methylphthalide

ChEBI IDCHEBI:202297
ChEBI Name5-(2',3'-epoxy-3',3'-dimethylpropoxy)-7-methoxy-6-methylphthalide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O5
Net Charge0
Average Mass278.304
Monoisotopic Mass278.11542
SMILESCOc1c(C)c(OC[C@@H]2OC2(C)C)cc2c1C(=O)OC2
InChIInChI=1S/C15H18O5/c1-8-10(18-7-11-15(2,3)20-11)5-9-6-19-14(16)12(9)13(8)17-4/h5,11H,6-7H2,1-4H3/t11-/m0/s1
InChIKeyIGRWJIGTYFRXTD-NSHDSACASA-N
Species of MetaboliteComponentSourceComments
Albatrellopsis confluens (ncbitaxon:2925186) - PubMed (25465923)
ChEBI Ontology
Outgoing Relation(s)
5-(2',3'-epoxy-3',3'-dimethylpropoxy)-7-methoxy-6-methylphthalide (CHEBI:202297) is a 2-benzofurans (CHEBI:38831)
IUPAC Name 
5-[(3,3-dimethyloxiran-2-yl)methoxy]-7-methoxy-6-methyl-3H-2-benzouran-1-one
Manual XrefsDatabases
78435608ChemSpider