CHEBI:88945 - TG(16:0/16:0/18:1(11Z))[iso3]

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name TG(16:0/16:0/18:1(11Z))[iso3]
ChEBI ID CHEBI:88945
Stars This entity has been manually annotated by a third party.
Supplier Information ZINC000085585332
Download Molfile XML SDF
Formula C53H100O6
Net Charge 0
Average Mass 833.360
Monoisotopic Mass 832.75199
InChI InChI=1S/C53H100O6/c1-4-7-10-13-16-19-22-25-26-29-31-34-37-40-43-46-52(55)58-49-50(59-53(56)47-44-41-38-35-32-28-24-21-18-15-12-9-6-3)48-57-51(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2/h19,22,50H,4-18,20-21,23-49H2,1-3H3/b22-19-/t50-/m1/s1
InChIKey ZKEWGTVAIGJNBK-VLBIAFCBSA-N
SMILES C([C@@](COC(CCCCCCCCCCCCCCC)=O)(OC(CCCCCCCCCCCCCCC)=O)[H])OC(CCCCCCCCC/C=C\CCCCCC)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood (UBERON:0000178). See: PubMed
ChEBI Ontology
Outgoing TG(16:0/16:0/18:1(11Z))[iso3] (CHEBI:88945) is a triglyceride (CHEBI:17855)
Synonyms Sources
(2R)-2,3-bis(hexadecanoyloxy)propyl (11Z)-octadec-11-enoate HMDB
1-Palmitoyl-2-palmitoyl-3-vaccenoyl-glycerol HMDB
TAG(16:0/16:0/18:1) HMDB
TAG(16:0/16:0/18:1n7) HMDB
TAG(16:0/16:0/18:1w7) HMDB
TAG(50:1) HMDB
TG(16:0/16:0/18:1) HMDB
TG(16:0/16:0/18:1n7) HMDB
TG(16:0/16:0/18:1w7) HMDB
TG(50:1) HMDB
Tracylglycerol(16:0/16:0/18:1) HMDB
Tracylglycerol(16:0/16:0/18:1n7) HMDB
Tracylglycerol(16:0/16:0/18:1w7) HMDB
Tracylglycerol(50:1) HMDB
Triacylglycerol HMDB
Triglyceride HMDB
Manual Xref Database
HMDB0010416 HMDB
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