In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03019RBK |
---|---|
Common Name | TG(13:0/18:1(13Z)/10:0) |
Systematic Name | 1-tridecanoyl-2-(13Z-octadecenoyl)-3-decanoyl-sn-glycerol |
Synonyms | TG(41:1); TG(10:0_13:0_18:1) |
Exact Mass | |
Formula | C44H82O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | IIMWMLCROKXUFF-COLQZRDTSA-N |
InChI | InChI=1S/C44H82O6/c1-4-7-10-13-16-18-20-21-22-23-24-26-29-32-35-38-44(47)50-41(3 9-48-42(45)36-33-30-27-15-12-9-6-3)40-49-43(46)37-34-31-28-25-19-17-14-11-8-5-2/ h13,16,41H,4-12,14-15,17-40H2,1-3H3/b16-13-/t41-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCC/C=C\CCCC)=O)COC(CCCCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |