CHEBI:192326 - DG(18:4(6Z,9Z,12Z,15Z)/14:1(9Z)/0:0)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name DG(18:4(6Z,9Z,12Z,15Z)/14:1(9Z)/0:0)
ChEBI ID CHEBI:192326
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C35H58O5
Net Charge 0
Average Mass 558.844
Monoisotopic Mass 558.42842
InChI InChI=1S/C35H58O5/c1-3-5-7-9-11-13-15-16-17-18-20-21-23-25-27-29-34(37)39-32-33(31-36)40-35(38)30-28-26-24-22-19-14-12-10-8-6-4-2/h5,7,10-13,16-17,20-21,33,36H,3-4,6,8-9,14-15,18-19,22-32H2,1-2H3/b7-5-,12-10-,13-11-,17-16-,21-20-/t33-/m0/s1
InChIKey DJPSDNJBZWPDDE-AVTGWHNUSA-N
SMILES O(C(=O)CCCCCCC/C=C\CCCC)[C@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)CO
Metabolite of Species Details
Ovis aries (NCBI:txid9940) Found in Rumen (NCIT:C98778). See: MetaboLights Study
ChEBI Ontology
Outgoing DG(18:4(6Z,9Z,12Z,15Z)/14:1(9Z)/0:0) (CHEBI:192326) is a lipid (CHEBI:18059)
IUPAC Name
[(2S)-3-hydroxy-2-[(Z)-tetradec-9-enoyl]oxypropyl] (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate
Manual Xrefs Databases
24766065 ChemSpider
HMDB0007328 HMDB
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