CHEBI:179892 - 5-methyl-octanoic acid

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ChEBI Name 5-methyl-octanoic acid
ChEBI ID CHEBI:179892
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H18O2
Net Charge 0
Average Mass 158.241
Monoisotopic Mass 158.13068
InChI InChI=1S/C9H18O2/c1-3-5-8(2)6-4-7-9(10)11/h8H,3-7H2,1-2H3,(H,10,11)
InChIKey GTKYBNNWJGLBNE-UHFFFAOYSA-N
SMILES OC(=O)CCCC(CCC)C
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 5-methyl-octanoic acid (CHEBI:179892) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name
5-methyloctanoic acid
Manual Xrefs Databases
4471753 ChemSpider
LMFA01020245 LIPID MAPS
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