In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049KZP |
---|---|
Common Name | TG(P-16:1(11Z)/11:0/18:0) |
Systematic Name | 1-(1Z,11Z-hexadecadienyl)-2-undecanoyl-3-octadecanoyl-sn-glycerol |
Synonyms | TG(P-45:1); TG(P-16:1_11:0_18:0) |
Exact Mass | |
Formula | C48H90O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | XSQABJINVYRAED-AWQGOBLMSA-N |
InChI | InChI=1S/C48H90O5/c1-4-7-10-13-16-19-21-23-25-26-28-30-33-35-38-41-47(49)52-45-4 6(53-48(50)42-39-36-32-18-15-12-9-6-3)44-51-43-40-37-34-31-29-27-24-22-20-17-14- 11-8-5-2/h14,17,40,43,46H,4-13,15-16,18-39,41-42,44-45H2,1-3H3/b17-14-,43-40-/t4 6-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCC)=O)CO/C=C\CCCCCCCC/C=C\CCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |