In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03019H77 |
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Common Name | TG(11:0/20:2(5Z,8Z)/11:0) |
Systematic Name | 1,3-di-undecanoyl-2-(5Z,8Z-eicosadienoyl)-sn-glycerol |
Synonyms | TG(42:2); TG(11:0_11:0_20:2) |
Exact Mass | |
Formula | C45H82O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | OCTUEWXYWKTPQI-SDHYIQMZSA-N |
InChI | InChI=1S/C45H82O6/c1-4-7-10-13-16-19-20-21-22-23-24-25-26-27-30-33-36-39-45(48)5 1-42(40-49-43(46)37-34-31-28-17-14-11-8-5-2)41-50-44(47)38-35-32-29-18-15-12-9-6 -3/h24-25,27,30,42H,4-23,26,28-29,31-41H2,1-3H3/b25-24-,30-27- |
SMILES | C(OC(=O)CCCCCCCCCC)[C@]([H])(OC(CCC/C=C\C/C=C\CCCCCCCCCCC)=O)COC(CCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |