Palmitodiolen
IUPAC 名称
1-(hexadecanoyloxy)-3-[(9Z)-octadec-9-enoyloxy]propan-2-yl (9Z)-octadec-9-enoate
描述
Palmitodiolen, also known as tag(16:0/18:1/18:1) or 1,2-di-(9z)-octadecenoyl-3-hexadecanoylglycerol, is a member of the class of compounds known as triacylglycerols. Triacylglycerols are glycerides consisting of three fatty acid chains covalently bonded to a glycerol molecule through ester linkages. Palmitodiolen is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Palmitodiolen can be found in cocoa bean, which makes palmitodiolen a potential biomarker for the consumption of this food product.
异构
CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCC\C=C/CCCCCCCC)OC(=O)CCCCCCC\C=C/CCCCCCCC
InChI标识符
InChI=1S/C55H102O6/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h25-28,52H,4-24,29-51H2,1-3H3/b27-25-,28-26-
键
JFISYPWOVQNHLS-LBXGSASVSA-N