In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049AAY |
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Common Name | TG(P-14:0/10:0/18:2(2E,4E)) |
Systematic Name | 2-decanoyl-3-(2E,4E-octadecadienoyl)-sn-glycerol |
Synonyms | TG(P-42:2); TG(P-14:0_10:0_18:2) |
Exact Mass | |
Formula | C45H82O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | XWBDBGDDOXBBGE-AYKCGWHRSA-N |
InChI | InChI=1S/C45H82O5/c1-4-7-10-13-16-18-20-22-23-24-25-27-30-32-35-38-44(46)49-42-4 3(50-45(47)39-36-33-29-15-12-9-6-3)41-48-40-37-34-31-28-26-21-19-17-14-11-8-5-2/ h30,32,35,37-38,40,43H,4-29,31,33-34,36,39,41-42H2,1-3H3/b32-30+,38-35-,40-37-/t 43-/m1/s1 |
SMILES | C(OC(=O)/C=C\C=C\CCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCC)=O)CO/C=C\CCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |