Beta-D-glucopyranose-6-phosphate
Accession Number : KLM0000174This work is released into the public domain; please see our release statement.
Synonyms :
G6P
Config Rule :
% 'beta-D-glucopyranose-6-phosphate'
config('beta-D-glucopyranose-6-phosphate',[
ring([
oxy,
anomeric(1,hydroxyl&&hyd;),
car(2,hyd&&hydroxyl;),
car(3,hydroxyl&&hyd;),
car(4,hyd&&hydroxyl;),
car(5,methylphosphate&&hyd;)])]).
Smiles String :
[C@2H]-1([O][C@2H]([C@2H]([OH])[C@2H]([C@2H]-1[OH])[OH])[C@2H2][O][P@2](=[O])([_
O-])[O-])[OH]
'beta-D-glucopyranose-6-phosphate'
Fischer Diagram :
Terminal :
% 'beta-D-glucopyranose-6-phosphate'
c(1,12,(0,chiral))-[c(2,left)~,o(1,right)~,o(2,up)~,h(1,down)~],
c(2,12,(0,chiral))-[c(3,left)~,c(1,right)~,h(3,up)~,o(3,down)~],
c(3,12,(0,chiral))-[c(4,left)~,c(2,right)~,o(4,up)~,h(5,down)~],
c(4,12,(0,chiral))-[c(5,left)~,c(3,right)~,h(7,up)~,o(5,down)~],
c(5,12,(0,chiral))-[o(1,left)~,c(4,right)~,c(6,up)~,h(9,down)~],
c(6,12,(0,nonchiral))-[h(10,left)~,h(11,right)~,o(6,up)~,c(5,down)~],
h(1,1,(0,nonchiral))-[c(1,up)~],
h(2,1,(0,nonchiral))-[o(2,nil)~],
h(3,1,(0,nonchiral))-[c(2,down)~],
h(4,1,(0,nonchiral))-[o(3,nil)~],
h(5,1,(0,nonchiral))-[c(3,up)~],
h(6,1,(0,nonchiral))-[o(4,nil)~],
h(7,1,(0,nonchiral))-[c(4,down)~],
h(8,1,(0,nonchiral))-[o(5,nil)~],
h(9,1,(0,nonchiral))-[c(5,up)~],
h(10,1,(0,nonchiral))-[c(6,right)~],
h(11,1,(0,nonchiral))-[c(6,left)~],
o(1,16,(0,nonchiral))-[c(1,left)~,c(5,right)~],
o(2,16,(0,nonchiral))-[h(2,nil)~,c(1,down)~],
o(3,16,(0,nonchiral))-[h(4,nil)~,c(2,up)~],
o(4,16,(0,nonchiral))-[h(6,nil)~,c(3,down)~],
o(5,16,(0,nonchiral))-[h(8,nil)~,c(4,up)~],
o(6,16,(0,nonchiral))-[p(1,right)~,c(6,down)~],
o(7,16,(-6.666666666666666E-01,nonchiral))-[p(1,left)?],
o(8,16,(-6.666666666666666E-01,nonchiral))-[p(1,up)?],
o(9,16,(-6.666666666666666E-01,nonchiral))-[p(1,down)?],
p(1,31,(0,nonchiral))-[o(6,left)~,o(7,right)?,o(9,up)?,o(8,down)?]
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.