In-Silico Structure database (LMISSD)
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LM ID | LMGL03019ABH |
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Common Name | TG(10:0/10:0/20:3(8Z,11Z,14Z)) |
Systematic Name | 1,2-di-decanoyl-3-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycerol |
Synonyms | TG(40:3); TG(10:0_10:0_20:3) |
Exact Mass | |
Formula | C43H76O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | LKIRCEYWXCRTIJ-PXUWDAEKSA-N |
InChI | InChI=1S/C43H76O6/c1-4-7-10-13-16-17-18-19-20-21-22-23-24-25-28-30-33-36-42(45)4 8-39-40(49-43(46)37-34-31-27-15-12-9-6-3)38-47-41(44)35-32-29-26-14-11-8-5-2/h16 -17,19-20,22-23,40H,4-15,18,21,24-39H2,1-3H3/b17-16-,20-19-,23-22-/t40-/m1/s1 |
SMILES | C(OC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC)[C@]([H])(OC(CCCCCCCCC)=O)COC(CCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |