CHEBI:195265 - methyl 2-(3-oxo-2-pentylcyclopentyl)acetate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name methyl 2-(3-oxo-2-pentylcyclopentyl)acetate
ChEBI ID CHEBI:195265
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H22O3
Net Charge 0
Average Mass 226.316
Monoisotopic Mass 226.15689
InChI InChI=1S/C13H22O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h10-11H,3-9H2,1-2H3
InChIKey KVWWIYGFBYDJQC-UHFFFAOYSA-N
SMILES O=C1C(C(CC1)CC(OC)=O)CCCCC
ChEBI Ontology
Outgoing methyl 2-(3-oxo-2-pentylcyclopentyl)acetate (CHEBI:195265) has functional parent jasmonic acid (CHEBI:18292)
methyl 2-(3-oxo-2-pentylcyclopentyl)acetate (CHEBI:195265) is a lipid (CHEBI:18059)
IUPAC Name
methyl 2-(3-oxo-2-pentylcyclopentyl)acetate
Manual Xref Database
92919 ChemSpider
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