In-Silico Structure database (LMISSD)
| |
LM ID | LMGL02019C1H |
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Common Name | DG(20:3(8Z,11Z,14Z)/12:0/0:0) |
Systematic Name | 1-(8Z,11Z,14Z-eicosatrienoyl)-2-dodecanoyl-sn-glycerol |
Synonyms | DG(32:3); DG(12:0_20:3) |
Exact Mass | |
Formula | C35H62O5 |
Category | Glycerolipids [GL] |
Main Class | Diradylglycerols [GL02] |
Sub Class | Diacylglycerols [GL0201] |
PubChem Compound ID (CID) | - |
InChIKey | VSDLLDGVNGQLQD-QPXDZMGPSA-N |
InChI | InChI=1S/C35H62O5/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-23-25-27-29-34(37)39- 32-33(31-36)40-35(38)30-28-26-24-21-12-10-8-6-4-2/h11,13,15-16,18-19,33,36H,3-10 ,12,14,17,20-32H2,1-2H3/b13-11-,16-15-,19-18-/t33-/m0/s1 |
SMILES | OC[C@]([H])(OC(CCCCCCCCCCC)=O)COC(CCCCCC/C=C\C/C=C\C/C=C\CCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |