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1,2-dinitroglycerol

MNXM9531 is deprecated and here replaced by MNXM731730
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM731730 Image of MNXM731730
referencemetacycM:CPD-144
formulaC3H6N2O7
global charge0
mol weight182.088
InChIKeyGFVHBTOOPNJKLV-VKHMYHEASA-N
InChIInChI=1S/C3H6N2O7/c6-1-3(12-5(9)10)2-11-4(7)8/h3,6H,1-2H2/t3-/m0/s1
SMILESO=[N+]([O-])OC[C@H](CO)O[N+](=O)[O-]
MNX internals
InChI (mnx)InChI=1/C3H6N2O7/c6-1-3(12-5(9)10)2-11-4(7)8/h3,6H,1-2H2/t3-/m0/s1 Image of MNXM731730
SMILES (mnx)[CH2:1]([C@@H:3]([CH2:2][O:11][N+:4]([O-:7])=[O:8])[O:12][N+:5]([O-:9])=[O:10])[OH:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)8
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-144
metacycM:CPD-144
GFVHBTOOPNJKLV-VKHMYHEASA-N 		1,2-dinitroglycerol
1,2,3-propanetriol 1,2-dinitrate
glycerol-1,2-dinitrate

seed.compound:cpd24340
seedM:cpd24340
GFVHBTOOPNJKLV-VKHMYHEASA-N 		1,2,3-propanetriol 1,2-dinitrate
1,2-dinitroglycerol
glycerol-1,2-dinitrate
hmdb:HMDB0244085
GFVHBTOOPNJKLV-UHFFFAOYSA-N 		1,2-Dinitroglycerin
1,2,3-Propanetriol, 1,2-dinitrate
1,2,3-Propanetriol, 1,2-dinitric acid
1,2-Dinitroglycerol
1,2-Glyceryl dinitrate
1,3-Dinitroglycerol
2,3-bis(nitrooxy)propan-1-ol
Dinitroglycerol
Glyceryl 1,2-dinitrate
Glyceryl 1,3-dinitrate
Glyceryl dinitrate
Glyceryl-1,2-dinitrate
Glyceryl-1,2-dinitric acid
Glyceryl-1,3-dinitrate
Propanetriol 1,2-dinitrate
Propanetriol 1,3-dinitrate
glyceryl-1,2-dinitrate

envipath:...4785616d2c97
envipathM:...4785616d2c97
GFVHBTOOPNJKLV-UHFFFAOYSA-N 		1,2-Dinitroglycerol

reactome:R-ALL-9620115
reactomeM:R-ALL-9620115
CHEBI:18898
chebi:18898
GFVHBTOOPNJKLV-UHFFFAOYSA-N 		1,2-dinitroglycerol
1,2,3-Propanetriol, 1,2-dinitrate
1,2-Dinitroglycerin
3-hydroxypropane-1,2-diyl dinitrate
Glyceryl-1,2-dinitrate

seedM:M_cpd24340 		secondary/obsolete/fantasy identifier