In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGL02019AAM
Common NameDG(10:0/17:1(9Z)/0:0)
Systematic Name1-decanoyl-2-(9Z-heptadecenoyl)-sn-glycerol
SynonymsDG(27:1); DG(10:0_17:1)
Exact Mass
496.4128 (neutral)    Calculate m/z:
FormulaC30H56O5
CategoryGlycerolipids [GL]
Main ClassDiradylglycerols [GL02]
Sub ClassDiacylglycerols [GL0201]
PubChem Compound ID (CID)-
InChIKeyOBBWZPIISNWSAS-OHOVLYHNSA-N
InChIInChI=1S/C30H56O5/c1-3-5-7-9-11-12-13-14-15-16-17-19-21-23-25-30(33)35-28(26-31)
27-34-29(32)24-22-20-18-10-8-6-4-2/h13-14,28,31H,3-12,15-27H2,1-2H3/b14-13-/t28-
/m0/s1
SMILESOC[C@]([H])(OC(CCCCCCC/C=C\CCCCCCC)=O)COC(CCCCCCCCC)=O
MS Spectra-      Predict MS/MS spectrum ([M+NH4]+)
StatusActive (generated by computational methods)