In-Silico Structure database (LMISSD)
| |
LM ID | LMGL02029AJ1 |
---|---|
Common Name | DG(O-18:0/18:1(4E)/0:0) |
Systematic Name | 1-octadecyl-2-(4E-octadecenoyl)-sn-glycerol |
Synonyms | DG(O-36:1); DG(O-18:0_18:1) |
Exact Mass | |
Formula | C39H76O4 |
Category | Glycerolipids [GL] |
Main Class | Diradylglycerols [GL02] |
Sub Class | 1-alkyl,2-acylglycerols [GL0202] |
PubChem Compound ID (CID) | - |
InChIKey | HNZQTLWGGIZVMY-JLJSIFNJSA-N |
InChI | InChI=1S/C39H76O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-42-37-38(36- 40)43-39(41)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h28,30,38,40H,3-27,29 ,31-37H2,1-2H3/b30-28+/t38-/m0/s1 |
SMILES | OC[C@]([H])(OC(CC/C=C/CCCCCCCCCCCCC)=O)COCCCCCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |