In-Silico Structure database (LMISSD)
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LM ID | LMGL02029ABT |
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Common Name | DG(O-14:0/22:4(7Z,10Z,13Z,16Z)/0:0) |
Systematic Name | 1-tetradecyl-2-(7Z,10Z,13Z,16Z-docosatetraenoyl)-sn-glycerol |
Synonyms | DG(O-36:4); DG(O-14:0_22:4) |
Exact Mass | |
Formula | C39H70O4 |
Category | Glycerolipids [GL] |
Main Class | Diradylglycerols [GL02] |
Sub Class | 1-alkyl,2-acylglycerols [GL0202] |
PubChem Compound ID (CID) | - |
InChIKey | FCXHBWQFDRRUGB-TYOQNAPESA-N |
InChI | InChI=1S/C39H70O4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-39( 41)43-38(36-40)37-42-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h11,13,17-18,20-21,23 -24,38,40H,3-10,12,14-16,19,22,25-37H2,1-2H3/b13-11-,18-17-,21-20-,24-23-/t38-/m 0/s1 |
SMILES | OC[C@]([H])(OC(CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)COCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |