4-methyl lauric acid (CHEBI:180107)

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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	4-methyl lauric acid

ChEBI ID	CHEBI:180107

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H26O2

Net Charge

Average Mass

214.349

Monoisotopic Mass

214.19328

InChI

InChI=1S/C13H26O2/c1-3-4-5-6-7-8-9-12(2)10-11-13(14)15/h12H,3-11H2,1-2H3,(H,14,15)

InChIKey

STDXFMGAJMQOFF-UHFFFAOYSA-N

SMILES

OC(=O)CCC(CCCCCCCC)C

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	4-methyl lauric acid (CHEBI:180107) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name

4-methyldodecanoic acid