In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03029K1S |
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Common Name | TG(O-16:1(11Z)/12:0/15:0) |
Systematic Name | 1-(11Z-hexadecenyl)-2-dodecanoyl-3-pentadecanoyl-sn-glycerol |
Synonyms | TG(O-43:1); TG(O-16:1_12:0_15:0) |
Exact Mass | |
Formula | C46H88O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Alkyldiacylglycerols [GL0302] |
PubChem Compound ID (CID) | - |
InChIKey | VTUQIMJQPMGGBC-VCEYGNNWSA-N |
InChI | InChI=1S/C46H88O5/c1-4-7-10-13-16-19-21-23-24-26-29-32-35-38-41-49-42-44(51-46(4 8)40-37-34-31-27-18-15-12-9-6-3)43-50-45(47)39-36-33-30-28-25-22-20-17-14-11-8-5 -2/h13,16,44H,4-12,14-15,17-43H2,1-3H3/b16-13-/t44-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCC)=O)COCCCCCCCCCC/C=C\CCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |