In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03019K8K |
---|---|
Common Name | TG(12:0/14:1(9Z)/11:0) |
Systematic Name | 1-dodecanoyl-2-(9Z-tetradecenoyl)-3-undecanoyl-sn-glycerol |
Synonyms | TG(37:1); TG(11:0_12:0_14:1) |
Exact Mass | |
Formula | C40H74O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | NGJRMIOUGJJNTA-KKUQKTRUSA-N |
InChI | InChI=1S/C40H74O6/c1-4-7-10-13-16-19-20-22-25-28-31-34-40(43)46-37(35-44-38(41)3 2-29-26-23-18-15-12-9-6-3)36-45-39(42)33-30-27-24-21-17-14-11-8-5-2/h13,16,37H,4 -12,14-15,17-36H2,1-3H3/b16-13-/t37-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCC)=O)COC(CCCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |