In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03029VOE |
---|---|
Common Name | TG(O-18:0/12:0/12:0) |
Systematic Name | 1-octadecyl-2-dodecanoyl-3-dodecanoyl-sn-glycerol |
Synonyms | TG(O-42:0); TG(O-18:0_12:0_12:0) |
Exact Mass | |
Formula | C45H88O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Alkyldiacylglycerols [GL0302] |
PubChem Compound ID (CID) | - |
InChIKey | FLTQGEOZLJVHRE-VZUYHUTRSA-N |
InChI | InChI=1S/C45H88O5/c1-4-7-10-13-16-19-20-21-22-23-24-25-28-31-34-37-40-48-41-43(5 0-45(47)39-36-33-30-27-18-15-12-9-6-3)42-49-44(46)38-35-32-29-26-17-14-11-8-5-2/ h43H,4-42H2,1-3H3/t43-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCC)=O)COCCCCCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |