CHEBI:189630 - TG(64:15)

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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 TG(64:15)
ChEBI ID CHEBI:189630
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C67H100O6
Net Charge 0
Average Mass 1001.531
Monoisotopic Mass 1000.75199
InChI InChI=1S/C67H100O6/c1-4-7-10-13-16-19-22-25-28-31-33-36-39-42-45-48-51-54-57-60-66(69)72-63-64(62-71-65(68)59-56-53-50-47-44-41-38-35-30-27-24-21-18-15-12-9-6-3)73-67(70)61-58-55-52-49-46-43-40-37-34-32-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-21,25-30,33-34,36-38,41-43,45-46,51-52,54-55,64H,4-6,9,12-15,22-24,31-32,35,39-40,44,47-50,53,56-63H2,1-3H3/b10-7-,11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-33-,37-34-,41-38-,45-42-,46-43-,54-51-,55-52-/t64-/m1/s1
InChIKey HOZSAHHNHMYEEG-NIYLBQFESA-N
SMILES O(C(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC)C[C@@H](OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in liver (BTO:0000759). See: MetaboLights Study
Mus musculus (NCBI:txid10090) Found in serum (BTO:0000133). See: MetaboLights Study
Mus musculus (NCBI:txid10090) Found in heart (BTO:0000562). See: MetaboLights Study
ChEBI Ontology
Outgoing TG(64:15) (CHEBI:189630) is a triglyceride (CHEBI:17855)
IUPAC Name
[(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]oxypropyl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
Manual Xrefs Databases
7825461 ChemSpider
LMGL03012553 LIPID MAPS
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