In-Silico Structure database (LMISSD)
| |
LM ID | LMGL0301GIQ0 |
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Common Name | TG(20:4(7E,10E,13E,16E)/10:0/11:0) |
Systematic Name | 1-(7E,10E,13E,16E-eicosatetraenoyl)-2-decanoyl-3-undecanoyl-sn-glycerol |
Synonyms | TG(41:4); TG(10:0_11:0_20:4) |
Exact Mass | |
Formula | C44H76O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | HKULYIAVMPWQAN-SAKHWOFDSA-N |
InChI | InChI=1S/C44H76O6/c1-4-7-10-13-16-18-19-20-21-22-23-24-25-26-29-31-34-37-43(46)4 9-40-41(50-44(47)38-35-32-27-15-12-9-6-3)39-48-42(45)36-33-30-28-17-14-11-8-5-2/ h10,13,18-19,21-22,24-25,41H,4-9,11-12,14-17,20,23,26-40H2,1-3H3/b13-10+,19-18+, 22-21+,25-24+/t41-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCCC)[C@]([H])(OC(CCCCCCCCC)=O)COC(CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCC )=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |