In-Silico Structure database (LMISSD)
| |
LM ID | LMGL02019GFV |
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Common Name | DG(17:2(9Z,12Z)/0:0/16:1(7Z)) |
Systematic Name | 1-(9Z,12Z-heptadecadienoyl)-3-(7Z-hexadecenoyl)-sn-glycerol |
Synonyms | DG(33:3); DG(16:1_17:2) |
Exact Mass | |
Formula | C36H64O5 |
Category | Glycerolipids [GL] |
Main Class | Diradylglycerols [GL02] |
Sub Class | Diacylglycerols [GL0201] |
PubChem Compound ID (CID) | - |
InChIKey | JEFVRCBMVRZCHZ-YUNJEXOKSA-N |
InChI | InChI=1S/C36H64O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36(39)41-33-34(37) 32-40-35(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h9,11,15,17-18,20,34,37H,3- 8,10,12-14,16,19,21-33H2,1-2H3/b11-9-,17-15-,20-18-/t34-/m0/s1 |
SMILES | C(OC(=O)CCCCC/C=C\CCCCCCCC)[C@]([H])(O)COC(CCCCCCC/C=C\C/C=C\CCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |