In-Silico Structure Database (LMISSD)

O H O O OH
Common Name
DG(O-14:0/16:1(9Z)/0:0)
Systematic Name
1-tetradecyl-2-(9Z-hexadecenoyl)-sn-glycerol
LM ID
LMGL02029AAK
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
524.480460
Formula
C33H64O4
Predict MS/MS spectrum ([M+NH4]+)
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MDLMOL SDF CSV TSV PNG
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Main

Classification

Category
Main Class
Sub Class
Glycerolipids [GL]
Diradylglycerols [GL02]
1-alkyl,2-acylglycerols [GL0202]

String Representations

InChiKey (Click to copy)
GITKSFZKPMOLST-UFDIJAIZSA-N
InChi (Click to copy)
InChI=1S/C33H64O4/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-33(35)37-32(30-34)31-36-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h13,15,32,34H,3-12,14,16-31H2,1-2H3/b15-13-/t32-/m0/s1
SMILES (Click to copy)
OC[C@]([H])(OC(CCCCCCC/C=C\CCCCCC)=O)COCCCCCCCCCCCCCC

References

Other Databases