CHEBI:178856 - TG(8:0/i-19:0/a-17:0)[rac]

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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(8:0/i-19:0/a-17:0)[rac]
ChEBI ID CHEBI:178856
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C47H90O6
Net Charge 0
Average Mass 751.231
Monoisotopic Mass 750.67374
InChI InChI=1S/C47H90O6/c1-6-8-9-25-32-37-45(48)51-40-44(41-52-46(49)38-33-28-23-19-16-15-18-22-27-31-36-43(5)7-2)53-47(50)39-34-29-24-20-14-12-10-11-13-17-21-26-30-35-42(3)4/h42-44H,6-41H2,1-5H3/t43?,44-/m0/s1
InChIKey UCRIFGMNDNSCHL-GGEHFJKESA-N
SMILES O(C(=O)CCCCCCCCCCCCCCCC(C)C)[C@H](COC(=O)CCCCCCCCCCCCC(CC)C)COC(=O)CCCCCCC
ChEBI Ontology
Outgoing TG(8:0/i-19:0/a-17:0)[rac] (CHEBI:178856) is a triglyceride (CHEBI:17855)
IUPAC Name
[(2S)-1-(14-methylhexadecanoyloxy)-3-octanoyloxypropan-2-yl] 17-methyloctadecanoate
Manual Xrefs Databases
59672743 ChemSpider
HMDB0071302 HMDB
View more database links