In-Silico Structure database (LMISSD)
| |
LM ID | LMGL0301EQ5K |
---|---|
Common Name | TG(20:1(11Z)/13:0/10:0) |
Systematic Name | 1-(11Z-eicosenoyl)-2-tridecanoyl-3-decanoyl-sn-glycerol |
Synonyms | TG(43:1); TG(10:0_13:0_20:1) |
Exact Mass | |
Formula | C46H86O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | PBXIJALTLHZURW-CPUJRAQQSA-N |
InChI | InChI=1S/C46H86O6/c1-4-7-10-13-16-18-20-21-22-23-24-25-26-28-30-33-36-39-45(48)5 1-42-43(41-50-44(47)38-35-32-29-15-12-9-6-3)52-46(49)40-37-34-31-27-19-17-14-11- 8-5-2/h21-22,43H,4-20,23-42H2,1-3H3/b22-21-/t43-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCC)=O)COC(CCCCCCCCC/C=C\CCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |