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CHEBI:177123 - 13-(3,4-dimethyl-5-propylfuran-2-yl)-tridecanoic acid

ChEBI IDCHEBI:177123
ChEBI Name13-(3,4-dimethyl-5-propylfuran-2-yl)-tridecanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H38O3
Net Charge0
Average Mass350.543
Monoisotopic Mass350.28210
SMILESCCCc1oc(CCCCCCCCCCCCC(=O)O)c(C)c1C
InChIInChI=1S/C22H38O3/c1-4-15-20-18(2)19(3)21(25-20)16-13-11-9-7-5-6-8-10-12-14-17-22(23)24/h4-17H2,1-3H3,(H,23,24)
InChIKeyIGZNOKSSNQTWMY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bos grunniens (ncbitaxon:30521) subcutaneous adipose tissue (BTO:0004042) Article
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
13-(3,4-dimethyl-5-propylfuran-2-yl)-tridecanoic acid (CHEBI:177123) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
13-(3,4-dimethyl-5-propyluran-2-yl)tridecanoic acid
Manual XrefsDatabases
57494631ChemSpider
HMDB0112078HMDB
LMFA01150019LIPID MAPS