In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03019XEM |
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Common Name | TG(14:0/18:2(9Z,12Z)/11:0) |
Systematic Name | 1-tetradecanoyl-2-(9Z,12Z-octadecadienoyl)-3-undecanoyl-sn-glycerol |
Synonyms | TG(43:2); TG(11:0_14:0_18:2) |
Exact Mass | |
Formula | C46H84O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | MWKFGECUMMDPSS-NZBOLUDNSA-N |
InChI | InChI=1S/C46H84O6/c1-4-7-10-13-16-19-21-22-23-24-26-28-31-34-37-40-46(49)52-43(4 1-50-44(47)38-35-32-29-18-15-12-9-6-3)42-51-45(48)39-36-33-30-27-25-20-17-14-11- 8-5-2/h16,19,22-23,43H,4-15,17-18,20-21,24-42H2,1-3H3/b19-16-,23-22-/t43-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C\C/C=C\CCCCC)=O)COC(CCCCCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |