13-eicosenoic acid (CHEBI:180279)

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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	13-eicosenoic acid

ChEBI ID	CHEBI:180279

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H38O2

Net Charge

Average Mass

310.522

Monoisotopic Mass

310.28718

InChI

InChI=1S/C20H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h7-8H,2-6,9-19H2,1H3,(H,21,22)/b8-7+

InChIKey

URXZXNYJPAJJOQ-BQYQJAHWSA-N

SMILES

OC(=O)CCCCCCCCCCC/C=C/CCCCCC

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	13-eicosenoic acid (CHEBI:180279) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name

(E)-icos-13-enoic acid