In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049VKH |
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Common Name | TG(P-18:0/10:0/18:2(9E,12E)) |
Systematic Name | 1-(1Z-octadecenyl)-2-decanoyl-3-(9E,12E-octadecadienoyl)-sn-glycerol |
Synonyms | TG(P-46:2); TG(P-18:0_10:0_18:2) |
Exact Mass | |
Formula | C49H90O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | CEFBTOIDNZSEAE-CGXATLHBSA-N |
InChI | InChI=1S/C49H90O5/c1-4-7-10-13-16-18-20-22-24-26-28-30-32-35-38-41-44-52-45-47(5 4-49(51)43-40-37-33-15-12-9-6-3)46-53-48(50)42-39-36-34-31-29-27-25-23-21-19-17- 14-11-8-5-2/h17,19,23,25,41,44,47H,4-16,18,20-22,24,26-40,42-43,45-46H2,1-3H3/b1 9-17+,25-23+,44-41-/t47-/m1/s1 |
SMILES | C(OC(=O)CCCCCCC/C=C/C/C=C/CCCCC)[C@]([H])(OC(CCCCCCCCC)=O)CO/C=C\CCCCCCCCCCCCCCC C |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |