In-Silico Structure database (LMISSD)
| |
LM ID | LMGL02019I16 |
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Common Name | DG(22:2(13Z,16Z)/0:0/11:0) |
Systematic Name | 1-(13Z,16Z-docosadienoyl)-3-undecanoyl-sn-glycerol |
Synonyms | DG(33:2); DG(11:0_22:2) |
Exact Mass | |
Formula | C36H66O5 |
Category | Glycerolipids [GL] |
Main Class | Diradylglycerols [GL02] |
Sub Class | Diacylglycerols [GL0201] |
PubChem Compound ID (CID) | - |
InChIKey | IMAZLRWBJGBRJW-XGDJSDRUSA-N |
InChI | InChI=1S/C36H66O5/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-25-27-29-31-36( 39)41-33-34(37)32-40-35(38)30-28-26-24-12-10-8-6-4-2/h11,13,15-16,34,37H,3-10,12 ,14,17-33H2,1-2H3/b13-11-,16-15-/t34-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCCC)[C@]([H])(O)COC(CCCCCCCCCCC/C=C\C/C=C\CCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |