CHEBI:178944 - TG(20:0/12:0/i-12:0)

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ChEBI Name TG(20:0/12:0/i-12:0)
ChEBI ID CHEBI:178944
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C47H90O6
Net Charge 0
Average Mass 751.231
Monoisotopic Mass 750.67374
InChI InChI=1S/C47H90O6/c1-5-7-9-11-13-15-16-17-18-19-20-21-22-24-25-30-34-38-45(48)51-41-44(53-47(50)40-36-32-26-23-14-12-10-8-6-2)42-52-46(49)39-35-31-28-27-29-33-37-43(3)4/h43-44H,5-42H2,1-4H3/t44-/m0/s1
InChIKey SPOUPMOLABFCDX-SJARJILFSA-N
SMILES O(C(=O)CCCCCCCCCCCCCCCCCCC)C[C@H](OC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCC(C)C
ChEBI Ontology
Outgoing TG(20:0/12:0/i-12:0) (CHEBI:178944) is a triglyceride (CHEBI:17855)
IUPAC Name
[(2S)-2-dodecanoyloxy-3-(10-methylundecanoyloxy)propyl] icosanoate
Manual Xrefs Databases
59664544 ChemSpider
HMDB0062958 HMDB
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