In-Silico Structure database (LMISSD)
| |
LM ID | LMGL030290XI |
---|---|
Common Name | TG(O-18:1(11Z)/11:0/14:0) |
Systematic Name | 1-(11Z-octadecenyl)-2-undecanoyl-3-tetradecanoyl-sn-glycerol |
Synonyms | TG(O-43:1); TG(O-18:1_11:0_14:0) |
Exact Mass | |
Formula | C46H88O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Alkyldiacylglycerols [GL0302] |
PubChem Compound ID (CID) | - |
InChIKey | OQFOLJAXXVSSSR-NBTXLFQMSA-N |
InChI | InChI=1S/C46H88O5/c1-4-7-10-13-16-19-21-22-23-24-25-27-29-32-35-38-41-49-42-44(5 1-46(48)40-37-34-30-18-15-12-9-6-3)43-50-45(47)39-36-33-31-28-26-20-17-14-11-8-5 -2/h19,21,44H,4-18,20,22-43H2,1-3H3/b21-19-/t44-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCC)=O)COCCCCCCCCCC/C=C\CCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |