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CHEBI:213746 - 6-(5-methoxycarbonyl-3-methylpent-2-enyl)-3,7-dihydroxy-5-methoxy-4-methylphthalan-1-one

ChEBI IDCHEBI:213746
ChEBI Name6-(5-methoxycarbonyl-3-methylpent-2-enyl)-3,7-dihydroxy-5-methoxy-4-methylphthalan-1-one
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H22O7
Net Charge0
Average Mass350.367
Monoisotopic Mass350.13655
SMILESCOC(=O)CCC(C)=CCc1c(O)c2c(c(C)c1OC)[C@@H](O)OC2=O
InChIInChI=1S/C18H22O7/c1-9(6-8-12(19)23-3)5-7-11-15(20)14-13(10(2)16(11)24-4)17(21)25-18(14)22/h5,17,20-21H,6-8H2,1-4H3/t17-/m0/s1
InChIKeyVIETWRMQYIXKOG-KRWDZBQOSA-N
Species of MetaboliteComponentSourceComments
Penicillium bialowiezense (ncbitaxon:293381) - PubMed (29986508)
ChEBI Ontology
Outgoing Relation(s)
6-(5-methoxycarbonyl-3-methylpent-2-enyl)-3,7-dihydroxy-5-methoxy-4-methylphthalan-1-one (CHEBI:213746) is a benzofurans (CHEBI:35259)
IUPAC Name 
methyl 6-(1,4-dihydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzouran-5-yl)-4-methylhex-4-enoate
Manual XrefsDatabases
78435271ChemSpider