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CHEBI:174873 - Myrigalone A

ChEBI IDCHEBI:174873
ChEBI NameMyrigalone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H20O4
Net Charge0
Average Mass300.354
Monoisotopic Mass300.13616
SMILESCC1C(=O)C(C(=O)CCc2ccccc2)C(=O)C(C)(C)C1=O
InChIInChI=1S/C18H20O4/c1-11-15(20)14(17(22)18(2,3)16(11)21)13(19)10-9-12-7-5-4-6-8-12/h4-8,11,14H,9-10H2,1-3H3
InChIKeyCTSXBYQFSBUGKB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Myrigalone A (CHEBI:174873) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
2,2,4-trimethyl-6-(3-phenylpropanoyl)cyclohexane-1,3,5-trione
Manual XrefsDatabases
HMDB0037245HMDB
9897045ChemSpider
LMPK12120594LIPID MAPS