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CHEBI:208513 - Marilone A

ChEBI IDCHEBI:208513
ChEBI NameMarilone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28O4
Net Charge0
Average Mass344.451
Monoisotopic Mass344.19876
SMILESCOc1c(C)c(OC/C=C(\C)CCC=C(C)C)cc2c1C(=O)O[C@H]2C
InChIInChI=1S/C21H28O4/c1-13(2)8-7-9-14(3)10-11-24-18-12-17-16(5)25-21(22)19(17)20(23-6)15(18)4/h8,10,12,16H,7,9,11H2,1-6H3/b14-10+/t16-/m0/s1
InChIKeyAGNAQFYRVWHPDW-DKGMDFAASA-N
Species of MetaboliteComponentSourceComments
Stachylidium (ncbitaxon:796327) - PubMed (22238541)
ChEBI Ontology
Outgoing Relation(s)
Marilone A (CHEBI:208513) is a terpene lactone (CHEBI:37668)
IUPAC Name 
5-[(2E)-3,7-dimethylocta-2,6-dienoxy]-7-methoxy-3,6-dimethyl-3H-2-benzouran-1-one
Manual XrefsDatabases
29214326ChemSpider