In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03019SNZ |
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Common Name | TG(13:0/20:1(13E)/10:0) |
Systematic Name | 1-tridecanoyl-2-(13E-eicosenoyl)-3-decanoyl-sn-glycerol |
Synonyms | TG(43:1); TG(10:0_13:0_20:1) |
Exact Mass | |
Formula | C46H86O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | RKVLLKXLUYBQEL-JJWHKLKUSA-N |
InChI | InChI=1S/C46H86O6/c1-4-7-10-13-16-18-20-21-22-23-24-25-26-28-31-34-37-40-46(49)5 2-43(41-50-44(47)38-35-32-29-15-12-9-6-3)42-51-45(48)39-36-33-30-27-19-17-14-11- 8-5-2/h18,20,43H,4-17,19,21-42H2,1-3H3/b20-18+/t43-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCC/C=C/CCCCCC)=O)COC(CCCCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |