In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03019ABN |
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Common Name | TG(10:0/10:0/20:4(7E,10E,13E,16E)) |
Systematic Name | 1,2-di-decanoyl-3-(7E,10E,13E,16E-eicosatetraenoyl)-sn-glycerol |
Synonyms | TG(40:4); TG(10:0_10:0_20:4) |
Exact Mass | |
Formula | C43H74O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | QMRWUEMSAVYXOT-QMDYVBTHSA-N |
InChI | InChI=1S/C43H74O6/c1-4-7-10-13-16-17-18-19-20-21-22-23-24-25-28-30-33-36-42(45)4 8-39-40(49-43(46)37-34-31-27-15-12-9-6-3)38-47-41(44)35-32-29-26-14-11-8-5-2/h10 ,13,17-18,20-21,23-24,40H,4-9,11-12,14-16,19,22,25-39H2,1-3H3/b13-10+,18-17+,21- 20+,24-23+/t40-/m1/s1 |
SMILES | C(OC(=O)CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCC)[C@]([H])(OC(CCCCCCCCC)=O)COC(CCCCCCCCC) =O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |