16-methyl-10-oxo-heptadecanoic acid (CHEBI:179228)

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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	16-methyl-10-oxo-heptadecanoic acid

ChEBI ID	CHEBI:179228

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H34O3

Net Charge

Average Mass

298.467

Monoisotopic Mass

298.25079

InChI

InChI=1S/C18H34O3/c1-16(2)12-8-7-10-14-17(19)13-9-5-3-4-6-11-15-18(20)21/h16H,3-15H2,1-2H3,(H,20,21)

InChIKey

DXSQWDXMGNYMDL-UHFFFAOYSA-N

SMILES

O=C(CCCCCC(C)C)CCCCCCCCC(O)=O

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	16-methyl-10-oxo-heptadecanoic acid (CHEBI:179228) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name

16-methyl-10-oxoheptadecanoic acid