In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03029AAN |
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Common Name | TG(O-14:0/10:0/17:2(9Z,12Z)) |
Systematic Name | 1-tetradecyl-2-decanoyl-3-(9Z,12Z-heptadecadienoyl)-sn-glycerol |
Synonyms | TG(O-41:2); TG(O-14:0_10:0_17:2) |
Exact Mass | |
Formula | C44H82O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Alkyldiacylglycerols [GL0302] |
PubChem Compound ID (CID) | - |
InChIKey | YXDBZOQYRUBIEQ-QSVQRNEBSA-N |
InChI | InChI=1S/C44H82O5/c1-4-7-10-13-16-18-20-22-23-24-26-29-31-34-37-43(45)48-41-42(4 9-44(46)38-35-32-28-15-12-9-6-3)40-47-39-36-33-30-27-25-21-19-17-14-11-8-5-2/h13 ,16,20,22,42H,4-12,14-15,17-19,21,23-41H2,1-3H3/b16-13-,22-20-/t42-/m1/s1 |
SMILES | C(OC(=O)CCCCCCC/C=C\C/C=C\CCCC)[C@]([H])(OC(CCCCCCCCC)=O)COCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |