In-Silico Structure database (LMISSD)
| |
LM ID | LMGL0301FR57 |
---|---|
Common Name | TG(20:4(5E,8E,11E,14E)/10:0/11:0) |
Systematic Name | 1-(5E,8E,11E,14E-eicosatetraenoyl)-2-decanoyl-3-undecanoyl-sn-glycerol |
Synonyms | TG(41:4); TG(10:0_11:0_20:4) |
Exact Mass | |
Formula | C44H76O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | QWSOIWVVCQNHEN-QLDHRGBHSA-N |
InChI | InChI=1S/C44H76O6/c1-4-7-10-13-16-18-19-20-21-22-23-24-25-26-29-31-34-37-43(46)4 9-40-41(50-44(47)38-35-32-27-15-12-9-6-3)39-48-42(45)36-33-30-28-17-14-11-8-5-2/ h16,18,20-21,23-24,26,29,41H,4-15,17,19,22,25,27-28,30-40H2,1-3H3/b18-16+,21-20+ ,24-23+,29-26+/t41-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCCC)[C@]([H])(OC(CCCCCCCCC)=O)COC(CCC/C=C/C/C=C/C/C=C/C/C=C/CCCCC )=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |