In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03019GFO |
---|---|
Common Name | TG(11:0/17:2(9Z,12Z)/12:0) |
Systematic Name | 1-undecanoyl-2-(9Z,12Z-heptadecadienoyl)-3-dodecanoyl-sn-glycerol |
Synonyms | TG(40:2); TG(11:0_12:0_17:2) |
Exact Mass | |
Formula | C43H78O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | MLRHRQNVUZZKSP-LIHIMURXSA-N |
InChI | InChI=1S/C43H78O6/c1-4-7-10-13-16-19-20-21-22-23-25-28-31-34-37-43(46)49-40(38-4 7-41(44)35-32-29-26-18-15-12-9-6-3)39-48-42(45)36-33-30-27-24-17-14-11-8-5-2/h13 ,16,20-21,40H,4-12,14-15,17-19,22-39H2,1-3H3/b16-13-,21-20-/t40-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C\C/C=C\CCCC)=O)COC(CCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |