CHEBI:142735 - N-(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl-(2S)-hydroxyglycine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl-(2S)-hydroxyglycine
ChEBI ID CHEBI:142735
ChEBI ASCII Name N-(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl-(2S)-hydroxyglycine
Definition An N-acyl-(2S)-hydroxyglycine resulting from the formal condensation of (9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid with the amino group of (2S)-hydroxyglycine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C20H33NO4
Net Charge 0
Average Mass 351.481
Monoisotopic Mass 351.24096
InChI InChI=1S/C20H33NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(22)21-19(23)20(24)25/h3-4,6-7,9-10,19,23H,2,5,8,11-17H2,1H3,(H,21,22)(H,24,25)/b4-3-,7-6-,10-9-/t19-/m0/s1
InChIKey VULBXMJTZIZSRA-MULKPHPQSA-N
SMILES C(N[C@H](C(O)=O)O)(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC
ChEBI Ontology
Outgoing N-(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl-(2S)-hydroxyglycine (CHEBI:142735) has functional parent α-linolenic acid (CHEBI:27432)
N-(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl-(2S)-hydroxyglycine (CHEBI:142735) is a N-acyl-(2S)-hydroxyglycine (CHEBI:142733)
N-(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl-(2S)-hydroxyglycine (CHEBI:142735) is conjugate acid of N-(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl-(2S)-hydroxyglycinate (CHEBI:142697)
Incoming N-(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl-(2S)-hydroxyglycinate (CHEBI:142697) is conjugate base of N-(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl-(2S)-hydroxyglycine (CHEBI:142735)
IUPAC Name
(2S)-hydroxy[(9Z,12Z,15Z)-octadeca-9,12,15-trienoylamino]acetic acid
Citation Waiting for Citations Type Source
10079066 PubMed citation SUBMITTER
Last Modified
05 December 2018