CHEBI:190793 - DG(18:4(6Z,9Z,12Z,15Z)/18:3(6Z,9Z,12Z)/0:0)

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ChEBI Name DG(18:4(6Z,9Z,12Z,15Z)/18:3(6Z,9Z,12Z)/0:0)
ChEBI ID CHEBI:190793
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C39H62O5
Net Charge 0
Average Mass 610.920
Monoisotopic Mass 610.45973
InChI InChI=1S/C39H62O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-26,37,40H,3-4,6,8-10,15-16,21-22,27-36H2,1-2H3/b7-5-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-/t37-/m0/s1
InChIKey SHLHYPMEWIXGTP-MBCLPVOKSA-N
SMILES O([C@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)CO)C(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC
Metabolite of Species Details
Oryza sativa (NCBI:txid4530) Found in root (BTO:0001188). See: MetaboLights Study
ChEBI Ontology
Outgoing DG(18:4(6Z,9Z,12Z,15Z)/18:3(6Z,9Z,12Z)/0:0) (CHEBI:190793) is a lipid (CHEBI:18059)
IUPAC Name
[(2S)-1-hydroxy-3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropan-2-yl] (6Z,9Z,12Z)-octadeca-6,9,12-trienoate
Manual Xrefs Databases
24766073 ChemSpider
HMDB0007336 HMDB
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