EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:73715 - (2E,4E,8E,10E)-dodecatetraenedioic acid

ChEBI IDCHEBI:73715
ChEBI Name(2E,4E,8E,10E)-dodecatetraenedioic acid
Stars
ASCII Name(2E,4E,8E,10E)-dodecatetraenedioic acid
DefinitionA dodecatetraenedioic acid with double bonds at positions 2, 4, 8, and 10 (all E isomer).
Last Modified11 September 2013
Submittermwilliams
DownloadsMolfile
FormulaC12H14O4
Net Charge0
Average Mass222.240
Monoisotopic Mass222.08921
SMILESO=C(O)/C=C/C=C/CC/C=C/C=C/C(=O)O
InChIInChI=1S/C12H14O4/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16/h3-10H,1-2H2,(H,13,14)(H,15,16)/b5-3+,6-4+,9-7+,10-8+
InChIKeySXPCMUCUZSVRMB-MIIZMDLZSA-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)
(2E,4E,8E,10E)-dodecatetraenedioic acid (CHEBI:73715) has role metabolite (CHEBI:25212)
(2E,4E,8E,10E)-dodecatetraenedioic acid (CHEBI:73715) is a dodecatetraenedioic acid (CHEBI:73717)
IUPAC Name 
(2E,4E,8E,10E)-dodeca-2,4,8,10-tetraenedioic acid
Synonyms  Source
(all-trans)-dodeca-2,4,8,10-tetraenedioic acidChEBI
(all-E)-dodeca-2,4,8,10-tetraenedioic acidChEBI
Manual XrefsDatabases
LMFA01170008LIPID MAPS
Registry NumbersSources
Reaxys:3605456Reaxys