Difference between revisions of "CPD-14594"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN0-901 RXN0-901] == * direction: ** REVERSIBLE * common name: ** xanthine dehydrogenase * ec numb...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14594 CPD-14594] == * smiles: ** CC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C...")
 
Line 1: Line 1:
−
[[Category:Reaction]]
+
[[Category:Metabolite]]
−
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN0-901 RXN0-901] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14594 CPD-14594] ==
−
* direction:
+
* smiles:
−
** REVERSIBLE
+
** CC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C
 +
* inchi key:
 +
** InChIKey=FERSMFQBWVBKQK-CXTTVELOSA-N
 
* common name:
 
* common name:
−
** xanthine dehydrogenase
+
** linustatin
−
* ec number:
+
* molecular weight:
−
** [http://enzyme.expasy.org/EC/1.17.1.4 EC-1.17.1.4]
+
** 409.389   
 
* Synonym(s):
 
* Synonym(s):
 +
** propanenitrile
 +
** [2-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyloxy)-2-methylpropiononitrile)]
  
−
== Reaction Formula ==
+
== Reaction(s) known to consume the compound ==
−
* With identifiers:
+
* [[RXN-13602]]
−
** 1 [[XANTHINE]][c] '''+''' 1 [[WATER]][c] '''+''' 1 [[NAD]][c] '''<=>''' 1 [[NADH]][c] '''+''' 1 [[PROTON]][c] '''+''' 1 [[URATE]][c]
+
== Reaction(s) known to produce the compound ==
−
* With common name(s):
+
== Reaction(s) of unknown directionality ==
−
** 1 xanthine[c] '''+''' 1 H2O[c] '''+''' 1 NAD+[c] '''<=>''' 1 NADH[c] '''+''' 1 H+[c] '''+''' 1 urate[c]
+
−
 
+
−
== Genes associated with this reaction  ==
+
−
Genes have been associated with this reaction based on different elements listed below.
+
−
* Gene: [[Ec-20_000230]]
+
−
** Source: [[annotation-esiliculosus_genome]]
+
−
*** Assignment: AUTOMATED-NAME-MATCH
+
−
** Source: [[orthology-aragem]]
+
−
* Gene: [[Ec-20_000210]]
+
−
** Source: [[annotation-esiliculosus_genome]]
+
−
*** Assignment: AUTOMATED-NAME-MATCH
+
−
** Source: [[orthology-aragem]]
+
−
== Pathways  ==
+
−
* [[PWY-5497]], purine nucleobases degradation II (anaerobic): [http://metacyc.org/META/NEW-IMAGE?object=PWY-5497 PWY-5497]
+
−
** '''8''' reactions found over '''24''' reactions in the full pathway
+
−
* [[SALVADEHYPOX-PWY]], adenosine nucleotides degradation II: [http://metacyc.org/META/NEW-IMAGE?object=SALVADEHYPOX-PWY SALVADEHYPOX-PWY]
+
−
** '''5''' reactions found over '''5''' reactions in the full pathway
+
−
* [[P164-PWY]], purine nucleobases degradation I (anaerobic): [http://metacyc.org/META/NEW-IMAGE?object=P164-PWY P164-PWY]
+
−
** '''4''' reactions found over '''17''' reactions in the full pathway
+
−
* [[PWY-6596]], adenosine nucleotides degradation I: [http://metacyc.org/META/NEW-IMAGE?object=PWY-6596 PWY-6596]
+
−
** '''6''' reactions found over '''8''' reactions in the full pathway
+
−
* [[PWY-6607]], guanosine nucleotides degradation I: [http://metacyc.org/META/NEW-IMAGE?object=PWY-6607 PWY-6607]
+
−
** '''2''' reactions found over '''4''' reactions in the full pathway
+
−
* [[PWY-6606]], guanosine nucleotides degradation II: [http://metacyc.org/META/NEW-IMAGE?object=PWY-6606 PWY-6606]
+
−
** '''3''' reactions found over '''4''' reactions in the full pathway
+
−
* [[PWY-6999]], theophylline degradation: [http://metacyc.org/META/NEW-IMAGE?object=PWY-6999 PWY-6999]
+
−
** '''2''' reactions found over '''9''' reactions in the full pathway
+
−
* [[PWY-6608]], guanosine nucleotides degradation III: [http://metacyc.org/META/NEW-IMAGE?object=PWY-6608 PWY-6608]
+
−
** '''2''' reactions found over '''4''' reactions in the full pathway
+
−
* [[PWY-5695]], urate biosynthesis/inosine 5'-phosphate degradation: [http://metacyc.org/META/NEW-IMAGE?object=PWY-5695 PWY-5695]
+
−
** '''3''' reactions found over '''4''' reactions in the full pathway
+
−
* [[PWY-6538]], caffeine degradation III (bacteria, via demethylation): [http://metacyc.org/META/NEW-IMAGE?object=PWY-6538 PWY-6538]
+
−
** '''2''' reactions found over '''7''' reactions in the full pathway
+
−
== Reconstruction information  ==
+
−
* Category: [[orthology]]
+
−
** Source: [[orthology-aragem]]
+
−
*** Tool: [[pantograph]]
+
−
* Category: [[annotation]]
+
−
** Source: [[annotation-esiliculosus_genome]]
+
−
*** Tool: [[pathwaytools]]
+
 
== External links  ==
 
== External links  ==
−
* RHEA:
+
* LIGAND-CPD:
−
** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=16669 16669]
+
** [http://www.genome.jp/dbget-bin/www_bget?C08333 C08333]
−
* LIGAND-RXN:
+
* CHEBI:
−
** [http://www.genome.jp/dbget-bin/www_bget?R02103 R02103]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=6483 6483]
−
* UNIPROT:
+
* PUBCHEM:
−
** [http://www.uniprot.org/uniprot/Q62637 Q62637]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=119301 119301]
−
** [http://www.uniprot.org/uniprot/P22811 P22811]
+
{{#set: smiles=CC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C}}
−
** [http://www.uniprot.org/uniprot/Q12553 Q12553]
+
{{#set: inchi key=InChIKey=FERSMFQBWVBKQK-CXTTVELOSA-N}}
−
** [http://www.uniprot.org/uniprot/P08793 P08793]
+
{{#set: common name=linustatin}}
−
** [http://www.uniprot.org/uniprot/P10351 P10351]
+
{{#set: molecular weight=409.389    }}
−
** [http://www.uniprot.org/uniprot/Q7M0I7 Q7M0I7]
+
{{#set: common name=propanenitrile|[2-(6-O-&beta;-D-glucopyranosyl-&beta;-D-glucopyranosyloxy)-2-methylpropiononitrile)]}}
−
** [http://www.uniprot.org/uniprot/Q7M0I8 Q7M0I8]
+
{{#set: consumed by=RXN-13602}}
−
** [http://www.uniprot.org/uniprot/Q7M0I9 Q7M0I9]
+
−
** [http://www.uniprot.org/uniprot/P47990 P47990]
+
−
** [http://www.uniprot.org/uniprot/P47989 P47989]
+
−
** [http://www.uniprot.org/uniprot/Q00519 Q00519]
+
−
{{#set: direction=REVERSIBLE}}
+
−
{{#set: common name=xanthine dehydrogenase}}
+
−
{{#set: ec number=EC-1.17.1.4}}
+
−
{{#set: gene associated=Ec-20_000230|Ec-20_000210}}
+
−
{{#set: in pathway=PWY-5497|SALVADEHYPOX-PWY|P164-PWY|PWY-6596|PWY-6607|PWY-6606|PWY-6999|PWY-6608|PWY-5695|PWY-6538}}
+
−
{{#set: reconstruction category=orthology|annotation}}
+
−
{{#set: reconstruction source=annotation-esiliculosus_genome|orthology-aragem}}
+
−
{{#set: reconstruction tool=pantograph|pathwaytools}}
+

Latest revision as of 19:51, 21 March 2018

Metabolite CPD-14594

  • smiles:
    • CC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C
  • inchi key:
    • InChIKey=FERSMFQBWVBKQK-CXTTVELOSA-N
  • common name:
    • linustatin
  • molecular weight:
    • 409.389
  • Synonym(s):
    • propanenitrile
    • [2-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyloxy)-2-methylpropiononitrile)]

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links




Retrieved from "http://gem-aureme.irisa.fr/ectogem/index.php?title=CPD-14594&oldid=29750"