In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGL02029AQF
Common NameDG(O-20:0/10:0/0:0)
Systematic Name1-eicosyl-2-decanoyl-sn-glycerol
SynonymsDG(O-30:0); DG(O-20:0_10:0)
Exact Mass
526.4961 (neutral)    Calculate m/z:
FormulaC33H66O4
CategoryGlycerolipids [GL]
Main ClassDiradylglycerols [GL02]
Sub Class1-alkyl,2-acylglycerols [GL0202]
PubChem Compound ID (CID)-
InChIKeyMAGCUPDCXWKKOA-YTTGMZPUSA-N
InChIInChI=1S/C33H66O4/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-27-29-36-31-
32(30-34)37-33(35)28-26-24-22-10-8-6-4-2/h32,34H,3-31H2,1-2H3/t32-/m0/s1
SMILESOC[C@]([H])(OC(CCCCCCCCC)=O)COCCCCCCCCCCCCCCCCCCCC
MS Spectra-      Predict MS/MS spectrum ([M+NH4]+)
StatusActive (generated by computational methods)