In-Silico Structure database (LMISSD)
| |
LM ID | LMGL0302908U |
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Common Name | TG(O-18:1(11Z)/14:1(9Z)/10:0) |
Systematic Name | 1-(11Z-octadecenyl)-2-(9Z-tetradecenoyl)-3-decanoyl-sn-glycerol |
Synonyms | TG(O-42:2); TG(O-18:1_10:0_14:1) |
Exact Mass | |
Formula | C45H84O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Alkyldiacylglycerols [GL0302] |
PubChem Compound ID (CID) | - |
InChIKey | XLLOWAFEAVQWNC-DWNFDUDRSA-N |
InChI | InChI=1S/C45H84O5/c1-4-7-10-13-16-18-20-21-22-23-24-26-28-31-34-37-40-48-41-43(4 2-49-44(46)38-35-32-29-15-12-9-6-3)50-45(47)39-36-33-30-27-25-19-17-14-11-8-5-2/ h14,17-18,20,43H,4-13,15-16,19,21-42H2,1-3H3/b17-14-,20-18-/t43-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCC)=O)COCCCCCCCCCC/C=C\CCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |