EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:79014 - trans-2-icosenoic acid

ChEBI IDCHEBI:79014
ChEBI Nametrans-2-icosenoic acid
Stars
ASCII Nametrans-2-icosenoic acid
DefinitionAn icosenoic acid in which the double bond is at the 2-3 position and has E configuration.
Last Modified14 July 2014
SubmitterGareth Owen
DownloadsMolfile
FormulaC20H38O2
Net Charge0
Average Mass310.522
Monoisotopic Mass310.28718
SMILESCCCCCCCCCCCCCCCCC/C=C/C(=O)O
InChIInChI=1S/C20H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h18-19H,2-17H2,1H3,(H,21,22)/b19-18+
InChIKeyFIKTURVKRGQNQD-VHEBQXMUSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
trans-2-icosenoic acid (CHEBI:79014) is a icosenoic acid (CHEBI:23902)
trans-2-icosenoic acid (CHEBI:79014) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
Incoming Relation(s)
(2E,19R)-19-hydroxyicos-2-enoic acid (CHEBI:79013) has functional parent trans-2-icosenoic acid (CHEBI:79014)
(2E)-20-hydroxyicos-2-enoic acid (CHEBI:79184) has functional parent trans-2-icosenoic acid (CHEBI:79014)
IUPAC Names 
(2E)-2-eicosenoic acid
(2E)-icos-2-enoic acid
(2E)-eicos-2-enoic acid
(2E)-2-icosenoic acid
(E)-2-icosenoic acid
(E)-2-eicosenoic acid
Registry NumbersSources
Reaxys:11329706Reaxys
CAS:26764-41-0ChemIDplus