In-Silico Structure database (LMISSD)
| |
LM ID | LMGL02019A4H |
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Common Name | DG(17:2(9Z,12Z)/16:0/0:0) |
Systematic Name | 1-(9Z,12Z-heptadecadienoyl)-2-hexadecanoyl-sn-glycerol |
Synonyms | DG(33:2); DG(16:0_17:2) |
Exact Mass | |
Formula | C36H66O5 |
Category | Glycerolipids [GL] |
Main Class | Diradylglycerols [GL02] |
Sub Class | Diacylglycerols [GL0201] |
PubChem Compound ID (CID) | - |
InChIKey | RQXWALXTNKUIQZ-AYOYKULDSA-N |
InChI | InChI=1S/C36H66O5/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-35(38)40-33-34(32- 37)41-36(39)31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h9,11,15,17,34,37H,3-8,10,1 2-14,16,18-33H2,1-2H3/b11-9-,17-15-/t34-/m0/s1 |
SMILES | OC[C@]([H])(OC(CCCCCCCCCCCCCCC)=O)COC(CCCCCCC/C=C\C/C=C\CCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |