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CHEBI:174306 - Lactaronecatorin A

ChEBI IDCHEBI:174306
ChEBI NameLactaronecatorin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESCC(CC1=C(CO)COC1=O)C1=CCC(C)(C)C1
InChIInChI=1S/C15H22O3/c1-10(11-4-5-15(2,3)7-11)6-13-12(8-16)9-18-14(13)17/h4,10,16H,5-9H2,1-3H3
InChIKeyASKJTZIKSPCIKT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Lactaronecatorin A (CHEBI:174306) is a terpene lactone (CHEBI:37668)
IUPAC Name 
4-[2-(4,4-dimethylcyclopenten-1-yl)propyl]-3-(hydroxymethyl)-2H-uran-5-one
Manual XrefsDatabases
8190576ChemSpider
HMDB0037529HMDB