oxaloacetate

Synonyms :

• OXALOACETATE

Config Rule :

% oxaloacetate


config(oxaloacetate,[
        chain([
                carboxyl,
                keto,
                methandiyl,
                carboxyl])]).

config(oxaloacetate,[
        chain([
                carboxyl,
                keto,
                methandiyl,
                carboxyl])]).

Smiles String :

[C@2H2]([C](=[O])[C](=[O])[O-])[C](=[O])[O-]

oxaloacetate

Fischer Diagram :

Terminal :

% oxaloacetate

c(1,12,(0,nonchiral))-[o(1,nil)?,o(2,nil)?,c(2,nil)~],
c(2,12,(0,nonchiral))-[o(3,nil)~~,c(3,right)~,c(1,nil)~],
c(3,12,(0,nonchiral))-[c(2,left)~,c(4,right)~,h(2,up)~,h(1,down)~],
c(4,12,(0,nonchiral))-[c(3,left)~,o(4,nil)?,o(5,nil)?],
h(1,1,(0,nonchiral))-[c(3,up)~],
h(2,1,(0,nonchiral))-[c(3,down)~],
o(1,16,(-5.0E-01,nonchiral))-[c(1,nil)?],
o(2,16,(-5.0E-01,nonchiral))-[c(1,nil)?],
o(3,16,(0,nonchiral))-[c(2,nil)~~],
o(4,16,(-5.0E-01,nonchiral))-[c(4,nil)?],
o(5,16,(-5.0E-01,nonchiral))-[c(4,nil)?]

The Terminals for all the Config Rules are in Prolog Definite Clause Grammar (DCG) form.They can be checked in the Manual here.

The compound's PDB file can be seen here.

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