In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049A18 |
---|---|
Common Name | TG(P-14:0/17:1(9Z)/16:1(9Z)) |
Systematic Name | 2-(9Z-heptadecenoyl)-3-(9Z-hexadecenoyl)-sn-glycerol |
Synonyms | TG(P-47:2); TG(P-14:0_16:1_17:1) |
Exact Mass | |
Formula | C50H92O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | VCJVOOBIBQTUMU-KSNRABIFSA-N |
InChI | InChI=1S/C50H92O5/c1-4-7-10-13-16-19-22-25-27-29-32-35-38-41-44-50(52)55-48(46-5 3-45-42-39-36-33-30-24-21-18-15-12-9-6-3)47-54-49(51)43-40-37-34-31-28-26-23-20- 17-14-11-8-5-2/h20,22-23,25,42,45,48H,4-19,21,24,26-41,43-44,46-47H2,1-3H3/b23-2 0-,25-22-,45-42-/t48-/m1/s1 |
SMILES | C(OC(=O)CCCCCCC/C=C\CCCCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCCCCC)=O)CO/C=C\CCCCCCCCCC CC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |