CHEBI:32377 - petroselaidate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name petroselaidate
ChEBI ID CHEBI:32377
Definition An unsaturated fatty acid anion resulting from the deprotonation of the carboxy group of petroselaidic acid. The major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C18H33O2
Net Charge -1
Average Mass 281.454
Monoisotopic Mass 281.24860
InChI InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h12-13H,2-11,14-17H2,1H3,(H,19,20)/p-1/b13-12+
InChIKey CNVZJPUDSLNTQU-OUKQBFOZSA-M
SMILES C(=O)(CCCC/C=C/CCCCCCCCCCC)[O-]
ChEBI Ontology
Outgoing petroselaidate (CHEBI:32377) is a long-chain fatty acid anion (CHEBI:57560)
petroselaidate (CHEBI:32377) is a unsaturated fatty acid anion (CHEBI:2580)
petroselaidate (CHEBI:32377) is conjugate base of petroselaidic acid (CHEBI:30829)
Incoming petroselaidic acid (CHEBI:30829) is conjugate acid of petroselaidate (CHEBI:32377)
IUPAC Name
(6E)-octadec-6-enoate
Synonyms Sources
6E-octadecenoate ChEBI
octadec-6t-enoate ChEBI
trans-6-octadecenoate ChEBI
trans-Δ6-octadecenoate ChEBI
trans-octadec-6-enoate ChEBI
Last Modified
10 November 2015