In-Silico Structure database (LMISSD)
| |
LM ID | LMGL0301A169 |
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Common Name | TG(17:1(9Z)/12:0/11:0) |
Systematic Name | 1-(9Z-heptadecenoyl)-2-dodecanoyl-3-undecanoyl-sn-glycerol |
Synonyms | TG(40:1); TG(11:0_12:0_17:1) |
Exact Mass | |
Formula | C43H80O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | KRVABESILISTKM-PFDVCBLKSA-N |
InChI | InChI=1S/C43H80O6/c1-4-7-10-13-16-19-20-21-22-23-25-27-30-33-36-42(45)48-39-40(3 8-47-41(44)35-32-29-26-18-15-12-9-6-3)49-43(46)37-34-31-28-24-17-14-11-8-5-2/h20 -21,40H,4-19,22-39H2,1-3H3/b21-20-/t40-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCC)=O)COC(CCCCCCC/C=C\CCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |