In-Silico Structure Database (LMISSD)
Common Name
TG(P-16:1(9Z)/18:2(9E,11E)/12:0)
Systematic Name
1-(1Z,9Z-hexadecadienyl)-2-(9E,11E-octadecadienoyl)-3-dodecanoyl-sn-glycerol
LM ID
LMGL03049RWD
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
756.663175
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
1Z-alkenyldiacylglycerols [GL0304]
String Representations
InChiKey (Click to copy)
LDAKAIQYIPVNMZ-SAGPPQOOSA-N
InChi (Click to copy)
InChI=1S/C49H88O5/c1-4-7-10-13-16-19-21-23-25-26-28-31-34-37-40-43-49(51)54-47(46-53-48(50)42-39-36-33-30-18-15-12-9-6-3)45-52-44-41-38-35-32-29-27-24-22-20-17-14-11-8-5-2/h19-23,25,41,44,47H,4-18,24,26-40,42-43,45-46H2,1-3H3/b21-19+,22-20-,25-23+,44-41-/t47-/m1/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C/C=C/CCCCCC)=O)CO/C=C\CCCCCC/C=C\CCCCCC