In-Silico Structure database (LMISSD)
| |
LM ID | LMGL0301A7IL |
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Common Name | TG(17:2(9Z,12Z)/12:0/10:0) |
Systematic Name | 1-(9Z,12Z-heptadecadienoyl)-2-dodecanoyl-3-decanoyl-sn-glycerol |
Synonyms | TG(39:2); TG(10:0_12:0_17:2) |
Exact Mass | |
Formula | C42H76O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | OVDCJCFFCYNXIW-FRRAIYMNSA-N |
InChI | InChI=1S/C42H76O6/c1-4-7-10-13-16-18-19-20-21-22-24-26-29-32-35-41(44)47-38-39(3 7-46-40(43)34-31-28-25-15-12-9-6-3)48-42(45)36-33-30-27-23-17-14-11-8-5-2/h13,16 ,19-20,39H,4-12,14-15,17-18,21-38H2,1-3H3/b16-13-,20-19-/t39-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCC)=O)COC(CCCCCCC/C=C\C/C=C\CCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |