In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03019F6G |
---|---|
Common Name | TG(11:0/16:1(7Z)/12:0) |
Systematic Name | 1-undecanoyl-2-(7Z-hexadecenoyl)-3-dodecanoyl-sn-glycerol |
Synonyms | TG(39:1); TG(11:0_12:0_16:1) |
Exact Mass | |
Formula | C42H78O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | LVTHJROJJWRMCX-IGRZOUGISA-N |
InChI | InChI=1S/C42H78O6/c1-4-7-10-13-16-19-20-21-22-24-27-30-33-36-42(45)48-39(37-46-4 0(43)34-31-28-25-18-15-12-9-6-3)38-47-41(44)35-32-29-26-23-17-14-11-8-5-2/h21-22 ,39H,4-20,23-38H2,1-3H3/b22-21-/t39-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCCC)[C@]([H])(OC(CCCCC/C=C\CCCCCCCC)=O)COC(CCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |