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CHEBI:92545 - 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid

ChEBI IDCHEBI:92545
ChEBI Name6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid
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DownloadsMolfile
FormulaC17H20O6
Net Charge0
Average Mass320.341
Monoisotopic Mass320.12599
SMILESCOc1c(C)c2c(c(O)c1CC=C(C)CCC(=O)O)C(=O)OC2
InChIInChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)
InChIKeyHPNSFSBZBAHARI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid (CHEBI:92545) is a 2-benzofurans (CHEBI:38831)
Manual XrefsDatabases
LSM-2681LINCS