In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049B2Z |
---|---|
Common Name | TG(P-14:0/18:2(9Z,11Z)/14:1(9Z)) |
Systematic Name | 2-(9Z,11Z-octadecadienoyl)-3-(9Z-tetradecenoyl)-sn-glycerol |
Synonyms | TG(P-46:3); TG(P-14:0_14:1_18:2) |
Exact Mass | |
Formula | C49H88O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | YLELTVKHSVVNAA-VQOLZEMOSA-N |
InChI | InChI=1S/C49H88O5/c1-4-7-10-13-16-19-22-24-25-26-28-31-34-37-40-43-49(51)54-47(4 5-52-44-41-38-35-32-29-23-20-17-14-11-8-5-2)46-53-48(50)42-39-36-33-30-27-21-18- 15-12-9-6-3/h15,18-19,22,24-25,41,44,47H,4-14,16-17,20-21,23,26-40,42-43,45-46H2 ,1-3H3/b18-15-,22-19-,25-24-,44-41-/t47-/m1/s1 |
SMILES | C(OC(=O)CCCCCCC/C=C\CCCC)[C@]([H])(OC(CCCCCCC/C=C\C=C/CCCCCC)=O)CO/C=C\CCCCCCCCC CCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |