In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03029AC5 |
---|---|
Common Name | TG(O-14:0/11:0/18:1(6Z)) |
Systematic Name | 1-tetradecyl-2-undecanoyl-3-(6Z-octadecenoyl)-sn-glycerol |
Synonyms | TG(O-43:1); TG(O-14:0_11:0_18:1) |
Exact Mass | |
Formula | C46H88O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Alkyldiacylglycerols [GL0302] |
PubChem Compound ID (CID) | - |
InChIKey | RQABQJMDKWWIES-LBPBQTMMSA-N |
InChI | InChI=1S/C46H88O5/c1-4-7-10-13-16-19-21-23-24-25-26-28-31-33-36-39-45(47)50-43-4 4(51-46(48)40-37-34-30-18-15-12-9-6-3)42-49-41-38-35-32-29-27-22-20-17-14-11-8-5 -2/h26,28,44H,4-25,27,29-43H2,1-3H3/b28-26-/t44-/m1/s1 |
SMILES | C(OC(=O)CCCC/C=C\CCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCC)=O)COCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |