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CHEBI:86544 - (2E)-oct-2-enoic acid

ChEBI IDCHEBI:86544
ChEBI Name(2E)-oct-2-enoic acid
Stars
ASCII Name(2E)-oct-2-enoic acid
DefinitionAn olefinic fatty acid that is octanoic acid carrying a double bond at position 2 (the 2E-isomer).
Last Modified19 July 2019
DownloadsMolfile
FormulaC8H14O2
Net Charge0
Average Mass142.198
Monoisotopic Mass142.09938
SMILESCCCCC/C=C/C(=O)O
InChIInChI=1S/C8H14O2/c1-2-3-4-5-6-7-8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/b7-6+
InChIKeyCWMPPVPFLSZGCY-VOTSOKGWSA-N
Species of MetaboliteComponentSourceComments
Aedes albopictus (ncbitaxon:7160) - PubMed (25049052)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
animal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
ChEBI Ontology
Outgoing Relation(s)
(2E)-oct-2-enoic acid (CHEBI:86544) has role animal metabolite (CHEBI:75767)
(2E)-oct-2-enoic acid (CHEBI:86544) is a medium-chain fatty acid (CHEBI:59554)
(2E)-oct-2-enoic acid (CHEBI:86544) is a monounsaturated fatty acid (CHEBI:25413)
(2E)-oct-2-enoic acid (CHEBI:86544) is a olefinic fatty acid (CHEBI:53339)
(2E)-oct-2-enoic acid (CHEBI:86544) is a straight-chain fatty acid (CHEBI:59202)
(2E)-oct-2-enoic acid (CHEBI:86544) is conjugate acid of (2E)-oct-2-enoate (CHEBI:143526)
Incoming Relation(s)
(2E)-oct-2-enoate (CHEBI:143526) is conjugate base of (2E)-oct-2-enoic acid (CHEBI:86544)
IUPAC Name 
(2E)-oct-2-enoic acid
Synonyms  Source
2-octenoic acidChEBI
(E)-2-octenoic acidHMDB
trans-2-octenoic acidHMDB
trans-α-octenoic acidLIPID MAPS
Manual XrefsDatabases
HMDB0001568HMDB
LMFA01030018LIPID MAPS
Registry NumbersSources
Reaxys:1721115Reaxys
CAS:1871-67-6ChemIDplus
Citations