In-Silico Structure database (LMISSD)
| |
LM ID | LMGL02019G44 |
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Common Name | DG(18:2(2E,4E)/0:0/14:1(9Z)) |
Systematic Name | 1-(2E,4E-octadecadienoyl)-3-(9Z-tetradecenoyl)-sn-glycerol |
Synonyms | DG(32:3); DG(14:1_18:2) |
Exact Mass | |
Formula | C35H62O5 |
Category | Glycerolipids [GL] |
Main Class | Diradylglycerols [GL02] |
Sub Class | Diacylglycerols [GL0201] |
PubChem Compound ID (CID) | - |
InChIKey | KQIFMXCOFYKTAQ-AHVXFKMHSA-N |
InChI | InChI=1S/C35H62O5/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-26-28-30-35(38)40-32-33( 36)31-39-34(37)29-27-25-23-21-19-14-12-10-8-6-4-2/h10,12,24,26,28,30,33,36H,3-9, 11,13-23,25,27,29,31-32H2,1-2H3/b12-10-,26-24+,30-28+/t33-/m0/s1 |
SMILES | C(OC(=O)CCCCCCC/C=C\CCCC)[C@]([H])(O)COC(/C=C/C=C/CCCCCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |