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CHEBI:192129 - 3-methyl-5-pentyl-2-furantridecanoic acid

ChEBI IDCHEBI:192129
ChEBI Name3-methyl-5-pentyl-2-furantridecanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H40O3
Net Charge0
Average Mass364.570
Monoisotopic Mass364.29775
SMILESCCCCCc1cc(C)c(CCCCCCCCCCCCC(=O)O)o1
InChIInChI=1S/C23H40O3/c1-3-4-13-16-21-19-20(2)22(26-21)17-14-11-9-7-5-6-8-10-12-15-18-23(24)25/h19H,3-18H2,1-2H3,(H,24,25)
InChIKeyJXBLMIJDQFTVIE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Marine plankton environmental sample (ncbitaxon:632957) - MetaboLights (MTBLS4424) Found in endometabolome.
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-methyl-5-pentyl-2-furantridecanoic acid (CHEBI:192129) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
13-(3-methyl-5-pentyluran-2-yl)tridecanoic acid
Manual XrefsDatabases
57494632ChemSpider
HMDB0061648HMDB
LMFA01150014LIPID MAPS