In-Silico Structure database (LMISSD)
| |
LM ID | LMGL0304AM3B |
---|---|
Common Name | TG(P-20:1(9Z)/13:0/13:0) |
Systematic Name | 1-(1Z,9Z-eicosadienyl)-2-tridecanoyl-3-tridecanoyl-sn-glycerol |
Synonyms | TG(P-46:1); TG(P-20:1_13:0_13:0) |
Exact Mass | |
Formula | C49H92O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | DHQWNFOQMCMHRH-YZRPEHPLSA-N |
InChI | InChI=1S/C49H92O5/c1-4-7-10-13-16-19-22-23-24-25-26-27-28-29-32-35-38-41-44-52-4 5-47(54-49(51)43-40-37-34-31-21-18-15-12-9-6-3)46-53-48(50)42-39-36-33-30-20-17- 14-11-8-5-2/h25-26,41,44,47H,4-24,27-40,42-43,45-46H2,1-3H3/b26-25-,44-41-/t47-/ m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCC)=O)CO/C=C\CCCCCC/C=C\CCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |