In-Silico Structure database (LMISSD)
| |
LM ID | LMGL02019C3T |
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Common Name | DG(20:4(5E,8E,11E,14E)/13:0/0:0) |
Systematic Name | 1-(5E,8E,11E,14E-eicosatetraenoyl)-2-tridecanoyl-sn-glycerol |
Synonyms | DG(33:4); DG(13:0_20:4) |
Exact Mass | |
Formula | C36H62O5 |
Category | Glycerolipids [GL] |
Main Class | Diradylglycerols [GL02] |
Sub Class | Diacylglycerols [GL0201] |
PubChem Compound ID (CID) | - |
InChIKey | HDWDGWXXZWTLTJ-RVWIJBBOSA-N |
InChI | InChI=1S/C36H62O5/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/h11,13,16-17,19-20,23-24,34 ,37H,3-10,12,14-15,18,21-22,25-33H2,1-2H3/b13-11+,17-16+,20-19+,24-23+/t34-/m0/s 1 |
SMILES | OC[C@]([H])(OC(CCCCCCCCCCCC)=O)COC(CCC/C=C/C/C=C/C/C=C/C/C=C/CCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |