CHEBI:180135 - 5-oxo capric acid

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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 5-oxo capric acid
ChEBI ID CHEBI:180135
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C10H18O3
Net Charge 0
Average Mass 186.251
Monoisotopic Mass 186.12559
InChI InChI=1S/C10H18O3/c1-2-3-4-6-9(11)7-5-8-10(12)13/h2-8H2,1H3,(H,12,13)
InChIKey SDKDCMWTAOZNGB-UHFFFAOYSA-N
SMILES O=C(CCCCC)CCCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 5-oxo capric acid (CHEBI:180135) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name
5-oxodecanoic acid
Manual Xrefs Databases
62555 ChemSpider
LMFA01060030 LIPID MAPS
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Registry Number Type Source
624-01-1 CAS Registry Number ChemIDplus