In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGL02019AQF
Common NameDG(15:1(9Z)/10:0/0:0)
Systematic Name1-(9Z-pentadecenoyl)-2-decanoyl-sn-glycerol
SynonymsDG(25:1); DG(10:0_15:1)
Exact Mass
468.3815 (neutral)    Calculate m/z:
FormulaC28H52O5
CategoryGlycerolipids [GL]
Main ClassDiradylglycerols [GL02]
Sub ClassDiacylglycerols [GL0201]
PubChem Compound ID (CID)-
InChIKeyAAWQSNADYPQWOM-ZQJVVAQZSA-N
InChIInChI=1S/C28H52O5/c1-3-5-7-9-11-12-13-14-15-17-18-20-22-27(30)32-25-26(24-29)33-
28(31)23-21-19-16-10-8-6-4-2/h11-12,26,29H,3-10,13-25H2,1-2H3/b12-11-/t26-/m0/s1
SMILESOC[C@]([H])(OC(CCCCCCCCC)=O)COC(CCCCCCC/C=C\CCCCC)=O
MS Spectra-      Predict MS/MS spectrum ([M+NH4]+)
StatusActive (generated by computational methods)