In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049VMC |
---|---|
Common Name | TG(P-18:0/11:0/17:0) |
Systematic Name | 1-(1Z-octadecenyl)-2-undecanoyl-3-heptadecanoyl-sn-glycerol |
Synonyms | TG(P-46:0); TG(P-18:0_11:0_17:0) |
Exact Mass | |
Formula | C49H94O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | PESXMLSMERNFNH-BSCSNSBOSA-N |
InChI | InChI=1S/C49H94O5/c1-4-7-10-13-16-19-21-23-25-26-28-30-32-35-38-41-44-52-45-47(5 4-49(51)43-40-37-33-18-15-12-9-6-3)46-53-48(50)42-39-36-34-31-29-27-24-22-20-17- 14-11-8-5-2/h41,44,47H,4-40,42-43,45-46H2,1-3H3/b44-41-/t47-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCC)=O)CO/C=C\CCCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |