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1,3-dinitroglycerol

PropertiesImage
MNX_IDMNXM32290 Image of MNXM32290
referencechebi:18921
formulaC3H6N2O7
global charge0
mol weight182.088
InChIKeyASIGVDLTBLZXNC-UHFFFAOYSA-N
InChIInChI=1S/C3H6N2O7/c6-3(1-11-4(7)8)2-12-5(9)10/h3,6H,1-2H2
SMILESO=[N+]([O-])OCC(O)CO[N+](=O)[O-]
MNX internals
InChI (mnx)InChI=1/C3H6N2O7/c6-3(1-11-4(7)8)2-12-5(9)10/h3,6H,1-2H2 Image of MNXM32290
SMILES (mnx)[CH2:1]([CH:3]([CH2:2][O:12][N+:5]([O-:9])=[O:10])[OH:6])[O:11][N+:4]([O-:7])=[O:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:18921
chebi:18921
ASIGVDLTBLZXNC-UHFFFAOYSA-N 		1,3-dinitroglycerol
1,2,3-propanetriol 1,3-dinitrate
1,2,3-propanetriol, 1,3-dinitrate
1,3-Dng
1,3-GDN
1,3-dinitroglycerin
1,3-glyceryl dinitrate
2-hydroxypropane-1,3-diyl dinitrate
glyceryl-1,3-dinitrate

seed.compound:cpd24341
seedM:cpd24341
ASIGVDLTBLZXNC-UHFFFAOYSA-N 		1,2,3-propanetriol 1,3-dinitrate
1,3-dinitroglycerol
glycerol-1,3-dinitrate
hmdb:HMDB0244171
ASIGVDLTBLZXNC-UHFFFAOYSA-N 		1,3-Dinitroglycerin
1,2,3-Propanetriol 1,3-dinitrate
1,2,3-Propanetriol 1,3-dinitric acid
1,2,3-Propanetriol, 1,3-dinitrate
1,2,3-Propanetriol, 1,3-dinitric acid
1,3-DNG
1,3-GDN
1,3-Glyceryl dinitrate
1,3-Glyceryl dinitric acid
2-hydroxy-3-(nitrooxy)propyl nitrate
Glyceryl-1,3-dinitrate
Glyceryl-1,3-dinitric acid

envipath:...9386f979292f
envipathM:...9386f979292f
ASIGVDLTBLZXNC-UHFFFAOYSA-N 		1,3-Dinitroglycerol

metacyc.compound:CPD-145
metacycM:CPD-145
ASIGVDLTBLZXNC-UHFFFAOYSA-N 		1,3-dinitroglycerol
1,2,3-propanetriol 1,3-dinitrate
glycerol-1,3-dinitrate

seedM:M_cpd24341 		secondary/obsolete/fantasy identifier