D-asparagine

Synonyms :

• D-ASPARAGINE

Config Rule :

config('D-asparagine',[
        substituent(aminoacid_D_backbone),
        substituent(methandiylamide),
        linkage(from(aminoacid_D_backbone,car(1)),
                to(methandiylamide,car(1)),
                up,single)]).

%%%% Substituent Config Rules for compound 'D-asparagine' %%%%

config(aminoacid_D_backbone,[
        center(car(1)),
        left(amino),
        right(hyd),
        bottom(carboxyl)]).

config(methandiylamide,[
        top(methandiyl(1,empty)),
        center(keto(2,amine))]).

Smiles String :

[C@2H]([NH3+])([C@2H2][C](=[O])[NH2])[C](=[O])[O-]

'D-asparagine'

Fischer Diagram :

Terminal :

% 'D-asparagine'

c(1,12,(0,chiral))-[n(1,left)~,h(1,right)~,c(3,up)~,c(2,down)~],
c(2,12,(0,nonchiral))-[o(1,nil)?,o(2,nil)?,c(1,up)~],
c(3,12,(0,nonchiral))-[c(4,left)~,h(7,right)~,h(8,up)~,c(1,down)~],
c(4,12,(0,nonchiral))-[o(3,nil)~~,c(3,right)~,n(2,nil)~],
h(1,1,(0,nonchiral))-[c(1,left)~],
h(2,1,(0,nonchiral))-[n(1,right)~],
h(3,1,(0,nonchiral))-[n(1,down)~],
h(4,1,(0,nonchiral))-[n(1,up)~],
h(5,1,(0,nonchiral))-[n(2,nil)~],
h(6,1,(0,nonchiral))-[n(2,nil)~],
h(7,1,(0,nonchiral))-[c(3,left)~],
h(8,1,(0,nonchiral))-[c(3,down)~],
n(1,14,(1,nonchiral))-[h(2,left)~,c(1,right)~,h(3,up)~,h(4,down)~],
n(2,14,(0,nonchiral))-[h(5,nil)~,h(6,nil)~,c(4,nil)~],
o(1,16,(-5.0E-01,nonchiral))-[c(2,nil)?],
o(2,16,(-5.0E-01,nonchiral))-[c(2,nil)?],
o(3,16,(0,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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