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CHEBI:115111 - 1-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-2-indolone

ChEBI IDCHEBI:115111
ChEBI Name1-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-2-indolone
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FormulaC25H21NO5
Net Charge0
Average Mass415.445
Monoisotopic Mass415.14197
SMILESCc1ccc(C(=O)CC2(O)C(=O)N(Cc3ccc4c(c3)OCO4)c3ccccc32)cc1
InChIInChI=1S/C25H21NO5/c1-16-6-9-18(10-7-16)21(27)13-25(29)19-4-2-3-5-20(19)26(24(25)28)14-17-8-11-22-23(12-17)31-15-30-22/h2-12,29H,13-15H2,1H3
InChIKeyCOQRQYLRLFIBOS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-2-indolone (CHEBI:115111) is a aromatic ketone (CHEBI:76224)
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LSM-26572LINCS