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CHEBI:73718 - tridecanedioic acid

ChEBI IDCHEBI:73718
ChEBI Nametridecanedioic acid
Stars
DefinitionAn α,ω-dicarboxylic acid that is undecane substituted by carboxylic acid groups at positions C-1 and C-11.
Last Modified11 September 2013
Submittermwilliams
DownloadsMolfile
FormulaC13H24O4
Net Charge0
Average Mass244.331
Monoisotopic Mass244.16746
SMILESO=C(O)CCCCCCCCCCCC(=O)O
InChIInChI=1S/C13H24O4/c14-12(15)10-8-6-4-2-1-3-5-7-9-11-13(16)17/h1-11H2,(H,14,15)(H,16,17)
InChIKeyDXNCZXXFRKPEPY-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
tridecanedioic acid (CHEBI:73718) has role metabolite (CHEBI:25212)
tridecanedioic acid (CHEBI:73718) is a α,ω-dicarboxylic acid (CHEBI:28383)
IUPAC Name 
tridecanedioic acid
Synonyms  Source
Undecane-1,11-dicarboxylic acidHMDB
1,13-Tridecanedioic acidHMDB
Brassilic acidHMDB
Brassylic acidHMDB
1,11-Undecanedicarboxylic acidHMDB
Manual XrefsDatabases
LMFA01170014LIPID MAPS
HMDB0002327HMDB
Registry NumbersSources
Reaxys:1786404Reaxys
CAS:505-52-2ChemIDplus
Citations