5-(3',3'-dimethylallyloxy)-7-methoxy-6-methylphthalide (CHEBI:203015)

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CHEBI:203015 - 5-(3',3'-dimethylallyloxy)-7-methoxy-6-methylphthalide

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ChEBI ID	CHEBI:203015
ChEBI Name	5-(3',3'-dimethylallyloxy)-7-methoxy-6-methylphthalide
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C15H18O4
Net Charge	0
Average Mass	262.305
Monoisotopic Mass	262.12051
SMILES	COc1c(C)c(OCC=C(C)C)cc2c1C(=O)OC2
InChI	InChI=1S/C15H18O4/c1-9(2)5-6-18-12-7-11-8-19-15(16)13(11)14(17-4)10(12)3/h5,7H,6,8H2,1-4H3
InChIKey	ZGSTXQWKCBWDFF-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Alternaria porri (ncbitaxon:48098)	-	DOI (10.1016/0031-9422(94)00546-6)

ChEBI Ontology

Outgoing Relation(s)
	5-(3',3'-dimethylallyloxy)-7-methoxy-6-methylphthalide (CHEBI:203015) is a 2-benzofurans (CHEBI:38831)

IUPAC Name
7-methoxy-6-methyl-5-(3-methylbut-2-enoxy)-3H-2-benzouran-1-one

Manual Xrefs	Databases
2782684	ChemSpider