CHEBI:185181 - TG(15:0/22:1(13Z)/18:0)

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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 TG(15:0/22:1(13Z)/18:0)
ChEBI ID CHEBI:185181
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C58H110O6
Net Charge 0
Average Mass 903.512
Monoisotopic Mass 902.83024
InChI InChI=1S/C58H110O6/c1-4-7-10-13-16-19-22-25-27-28-29-30-32-34-37-40-43-46-49-52-58(61)64-55(53-62-56(59)50-47-44-41-38-35-24-21-18-15-12-9-6-3)54-63-57(60)51-48-45-42-39-36-33-31-26-23-20-17-14-11-8-5-2/h25,27,55H,4-24,26,28-54H2,1-3H3/b27-25-/t55-/m0/s1
InChIKey PKSPQURTZBPRPW-AFHCKBSLSA-N
SMILES O([C@H](COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCC)C(=O)CCCCCCCCCCC/C=C\CCCCCCCC
Metabolite of Species Details
Bos taurus (NCBI:txid9913) Found in spermatozoon (BTO:0001277). of strain Holstein [LBO:0000132] See: MetaboLights Study
ChEBI Ontology
Outgoing TG(15:0/22:1(13Z)/18:0) (CHEBI:185181) is a triglyceride (CHEBI:17855)
IUPAC Name
[(2S)-1-octadecanoyloxy-3-pentadecanoyloxypropan-2-yl] (Z)-docos-13-enoate
Manual Xrefs Databases
59652851 ChemSpider
HMDB0043339 HMDB
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