In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03019QJZ |
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Common Name | TG(13:0/14:1(9Z)/13:0) |
Systematic Name | 1,3-di-tridecanoyl-2-(9Z-tetradecenoyl)-sn-glycerol |
Synonyms | TG(40:1); TG(13:0_13:0_14:1) |
Exact Mass | |
Formula | C43H80O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | MWCALSZNWPSXKX-SSZFMOIBSA-N |
InChI | InChI=1S/C43H80O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-43(46)49-40(38-47-41(44)3 5-32-29-26-23-20-17-14-11-8-5-2)39-48-42(45)36-33-30-27-24-21-18-15-12-9-6-3/h13 ,16,40H,4-12,14-15,17-39H2,1-3H3/b16-13- |
SMILES | C(OC(=O)CCCCCCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCC)=O)COC(CCCCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |