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CHEBI:121263 - 2-[(4,4-dimethyl-2,6-dioxocyclohexyl)-(3-pyridinyl)methyl]-5,5-dimethylcyclohexane-1,3-dione

ChEBI IDCHEBI:121263
ChEBI Name2-[(4,4-dimethyl-2,6-dioxocyclohexyl)-(3-pyridinyl)methyl]-5,5-dimethylcyclohexane-1,3-dione
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DownloadsMolfile
FormulaC22H27NO4
Net Charge0
Average Mass369.461
Monoisotopic Mass369.19401
SMILESCC1(C)CC(=O)C(C(c2cccnc2)C2C(=O)CC(C)(C)CC2=O)C(=O)C1
InChIInChI=1S/C22H27NO4/c1-21(2)8-14(24)19(15(25)9-21)18(13-6-5-7-23-12-13)20-16(26)10-22(3,4)11-17(20)27/h5-7,12,18-20H,8-11H2,1-4H3
InChIKeyZPDTUZGUAQLSTI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(4,4-dimethyl-2,6-dioxocyclohexyl)-(3-pyridinyl)methyl]-5,5-dimethylcyclohexane-1,3-dione (CHEBI:121263) is a sesquiterpenoid (CHEBI:26658)
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LSM-32706LINCS