Difference between revisions of "RXN-7567"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DIETHYLPHOSPHATE DIETHYLPHOSPHATE] == * smiles: ** CCOP(=O)([O-])OCC * common name: ** diethylp...")
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-7567 RXN-7567] == * direction: ** LEFT-TO-RIGHT * common name: ** indole-3-acetonitrile hydrata...")
 
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[[Category:Metabolite]]
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[[Category:Reaction]]
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DIETHYLPHOSPHATE DIETHYLPHOSPHATE] ==
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-7567 RXN-7567] ==
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* smiles:
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* direction:
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** CCOP(=O)([O-])OCC
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** LEFT-TO-RIGHT
 
* common name:
 
* common name:
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** diethylphosphate
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** indole-3-acetonitrile hydratase
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* inchi key:
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** probable_nitrile_hydratase
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** InChIKey=UCQFCFPECQILOL-UHFFFAOYSA-M
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* ec number:
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* molecular weight:
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** [http://enzyme.expasy.org/EC/4.2.1.84 EC-4.2.1.84]
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** 153.094   
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* Synonym(s):
 
* Synonym(s):
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** Diethylphosphoric acid
 
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** O,O-diethylphosphoric acid
 
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** phosphoric acid, diethyl ester
 
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** diethyl hydrogen phosphate
 
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** diethyl phosphoric acid
 
  
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== Reaction(s) known to consume the compound ==
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== Reaction Formula ==
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== Reaction(s) known to produce the compound ==
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* With identifiers:
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* [[RXN-8746]]
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** 1 [[INDOLEYL-CPD]][c] '''+''' 1 [[WATER]][c] '''=>''' 1 [[CPD-237]][c]
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== Reaction(s) of unknown directionality ==
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* With common name(s):
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** 1 indole-3-acetonitrile[c] '''+''' 1 H2O[c] '''=>''' 1 indole-3-acetamide[c]
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== Genes associated with this reaction  ==
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Genes have been associated with this reaction based on different elements listed below.
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* Gene: [[Tiso_gene_4032]]
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** Source: [[annotation-in-silico_annotation]]
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*** Assignment: EC-NUMBER
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== Pathways  ==
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* [[PWY-581]], indole-3-acetate biosynthesis II: [http://metacyc.org/META/NEW-IMAGE?object=PWY-581 PWY-581]
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** '''3''' reactions found over '''13''' reactions in the full pathway
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* [[PWY-5025]], indole-3-acetate biosynthesis IV (bacteria): [http://metacyc.org/META/NEW-IMAGE?object=PWY-5025 PWY-5025]
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** '''2''' reactions found over '''2''' reactions in the full pathway
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== Reconstruction information  ==
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* Category: [[annotation]]
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** Source: [[annotation-in-silico_annotation]]
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*** Tool: [[pathwaytools]]
 
== External links  ==
 
== External links  ==
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* CAS : 598-02-7
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* LIGAND-RXN:
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* PUBCHEM:
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** [http://www.genome.jp/dbget-bin/www_bget?R04020 R04020]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5166299 5166299]
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{{#set: direction=LEFT-TO-RIGHT}}
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* CHEMSPIDER:
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{{#set: common name=indole-3-acetonitrile hydratase}}
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** [http://www.chemspider.com/Chemical-Structure.4338966.html 4338966]
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{{#set: common name=probable_nitrile_hydratase}}
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* HMDB : HMDB12209
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{{#set: ec number=EC-4.2.1.84}}
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* LIGAND-CPD:
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{{#set: gene associated=Tiso_gene_4032}}
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** [http://www.genome.jp/dbget-bin/www_bget?C06608 C06608]
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{{#set: in pathway=PWY-581|PWY-5025}}
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{{#set: smiles=CCOP(=O)([O-])OCC}}
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{{#set: reconstruction category=annotation}}
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{{#set: common name=diethylphosphate}}
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{{#set: reconstruction source=annotation-in-silico_annotation}}
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{{#set: inchi key=InChIKey=UCQFCFPECQILOL-UHFFFAOYSA-M}}
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: molecular weight=153.094    }}
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{{#set: common name=Diethylphosphoric acid|O,O-diethylphosphoric acid|phosphoric acid, diethyl ester|diethyl hydrogen phosphate|diethyl phosphoric acid}}
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{{#set: produced by=RXN-8746}}
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Latest revision as of 21:02, 21 March 2018

Reaction RXN-7567

  • direction:
    • LEFT-TO-RIGHT
  • common name:
    • indole-3-acetonitrile hydratase
    • probable_nitrile_hydratase
  • ec number:
  • Synonym(s):

Reaction Formula

  • With identifiers:
  • With common name(s):
    • 1 indole-3-acetonitrile[c] + 1 H2O[c] => 1 indole-3-acetamide[c]

Genes associated with this reaction

Genes have been associated with this reaction based on different elements listed below.

Pathways

  • PWY-581, indole-3-acetate biosynthesis II: PWY-581
    • 3 reactions found over 13 reactions in the full pathway
  • PWY-5025, indole-3-acetate biosynthesis IV (bacteria): PWY-5025
    • 2 reactions found over 2 reactions in the full pathway

Reconstruction information

External links





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