In-Silico Structure database (LMISSD)
| |
LM ID | LMGL0302AHNA |
---|---|
Common Name | TG(O-20:1(11Z)/11:0/11:0) |
Systematic Name | 1-(11Z-eicosenyl)-2-undecanoyl-3-undecanoyl-sn-glycerol |
Synonyms | TG(O-42:1); TG(O-20:1_11:0_11:0) |
Exact Mass | |
Formula | C45H86O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Alkyldiacylglycerols [GL0302] |
PubChem Compound ID (CID) | - |
InChIKey | PIYMIRYNWZIRAZ-CHHOUSFJSA-N |
InChI | InChI=1S/C45H86O5/c1-4-7-10-13-16-19-20-21-22-23-24-25-26-27-28-31-34-37-40-48-4 1-43(50-45(47)39-36-33-30-18-15-12-9-6-3)42-49-44(46)38-35-32-29-17-14-11-8-5-2/ h21-22,43H,4-20,23-42H2,1-3H3/b22-21-/t43-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCC)=O)COCCCCCCCCCC/C=C\CCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |