CHEBI:185864 - Ethyl octynecarboxylate

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ChEBI Name Ethyl octynecarboxylate
ChEBI ID CHEBI:185864
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C11H18O2
Net Charge 0
Average Mass 182.263
Monoisotopic Mass 182.13068
InChI InChI=1S/C11H18O2/c1-3-5-6-7-8-9-10-11(12)13-4-2/h3-8H2,1-2H3
InChIKey BFZNMUGAZYAMTG-UHFFFAOYSA-N
SMILES O(CC)C(=O)C#CCCCCCC
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing Ethyl octynecarboxylate (CHEBI:185864) is a fatty acid ester (CHEBI:35748)
IUPAC Name
ethyl non-2-ynoate
Manual Xrefs Databases
55374 ChemSpider
HMDB0036215 HMDB
LMFA07010879 LIPID MAPS
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Registry Number Type Source
10031-92-2 CAS Registry Number ChemIDplus