CHEBI:177721 - Methyl 9-oxononanoate

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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 9-oxononanoate
ChEBI ID CHEBI:177721
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H18O3
Net Charge 0
Average Mass 186.251
Monoisotopic Mass 186.12559
InChI InChI=1S/C10H18O3/c1-13-10(12)8-6-4-2-3-5-7-9-11/h9H,2-8H2,1H3
InChIKey JMLYDLZRFNYHHO-UHFFFAOYSA-N
SMILES O(C(=O)CCCCCCCC=O)C
Metabolite of Species Details
Sus scrofa (NCBI:txid9823) Found in Sausage (ENVO:00002166). See: MetaboLights Study
ChEBI Ontology
Outgoing Methyl 9-oxononanoate (CHEBI:177721) is a fatty aldehyde (CHEBI:35746)
IUPAC Name
methyl 9-oxononanoate
Manual Xref Database
67304 ChemSpider
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Registry Number Type Source
1931-63-1 CAS Registry Number ChemIDplus