In-Silico Structure database (LMISSD)
| |
LM ID | LMGL02019CPZ |
---|---|
Common Name | DG(20:1(13E)/13:0/0:0) |
Systematic Name | 1-(13E-eicosenoyl)-2-tridecanoyl-sn-glycerol |
Synonyms | DG(33:1); DG(13:0_20:1) |
Exact Mass | |
Formula | C36H68O5 |
Category | Glycerolipids [GL] |
Main Class | Diradylglycerols [GL02] |
Sub Class | Diacylglycerols [GL0201] |
PubChem Compound ID (CID) | - |
InChIKey | NVSOBYDBZFBNBQ-DWDIVVRWSA-N |
InChI | InChI=1S/C36H68O5/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-24-26-28-30-35(38)40- 33-34(32-37)41-36(39)31-29-27-25-22-14-12-10-8-6-4-2/h13,15,34,37H,3-12,14,16-33 H2,1-2H3/b15-13+/t34-/m0/s1 |
SMILES | OC[C@]([H])(OC(CCCCCCCCCCCC)=O)COC(CCCCCCCCCCC/C=C/CCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |