In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGL02049ABP
Common NameDG(P-14:0/21:0/0:0)
Systematic Name1-(1Z-tetradecenyl)-2-heneicosanoyl-sn-glycerol
SynonymsDG(P-35:0); DG(P-14:0_21:0)
Exact Mass
594.5587 (neutral)    Calculate m/z:
FormulaC38H74O4
CategoryGlycerolipids [GL]
Main ClassDiradylglycerols [GL02]
Sub Class1Z-alkenylacylglycerols [GL0204]
PubChem Compound ID (CID)-
InChIKeyPUDFFJHYZAIRCU-CCBNGBJMSA-N
InChIInChI=1S/C38H74O4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-38(40)
42-37(35-39)36-41-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h32,34,37,39H,3-31,33,35
-36H2,1-2H3/b34-32-/t37-/m0/s1
SMILESOC[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCC)=O)CO/C=C\CCCCCCCCCCCC
MS Spectra-      Predict MS/MS spectrum ([M+NH4]+)
StatusActive (generated by computational methods)