In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03019G7A |
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Common Name | TG(11:0/18:2(6Z,9Z)/10:0) |
Systematic Name | 1-undecanoyl-2-(6Z,9Z-octadecadienoyl)-3-decanoyl-sn-glycerol |
Synonyms | TG(39:2); TG(10:0_11:0_18:2) |
Exact Mass | |
Formula | C42H76O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | YXOPCXQXARDSES-ILAGSHQQSA-N |
InChI | InChI=1S/C42H76O6/c1-4-7-10-13-16-18-19-20-21-22-23-24-27-30-33-36-42(45)48-39(3 7-46-40(43)34-31-28-25-15-12-9-6-3)38-47-41(44)35-32-29-26-17-14-11-8-5-2/h20-21 ,23-24,39H,4-19,22,25-38H2,1-3H3/b21-20-,24-23-/t39-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCC)[C@]([H])(OC(CCCC/C=C\C/C=C\CCCCCCCC)=O)COC(CCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |