Difference between revisions of "PWY-1269"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14047 RXN-14047] == * direction: ** REVERSIBLE * common name: ** Aconitate hydratase 2 (Aconita...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-16819 CPD-16819] == * smiles: ** CC1(C=CC(=CC=1)OS(=O)(=O)[O-]) * common name: ** 4-methylp...")
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[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14047 RXN-14047] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-16819 CPD-16819] ==
* direction:
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* smiles:
** REVERSIBLE
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** CC1(C=CC(=CC=1)OS(=O)(=O)[O-])
 
* common name:
 
* common name:
** Aconitate hydratase 2 (Aconitase)
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** 4-methylphenyl sulfate
* ec number:
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* inchi key:
** [http://enzyme.expasy.org/EC/4.2.1.3 EC-4.2.1.3]
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** InChIKey=WGNAKZGUSRVWRH-UHFFFAOYSA-M
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* molecular weight:
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** 187.19   
 
* Synonym(s):
 
* Synonym(s):
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** p-cresol sulfate
  
== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
* With identifiers:
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== Reaction(s) known to produce the compound ==
** 1 [[CIT]][c] '''<=>''' 1 [[THREO-DS-ISO-CITRATE]][c]
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== Reaction(s) of unknown directionality ==
* With common name(s):
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* [[RXN-15588]]
** 1 citrate[c] '''<=>''' 1 D-threo-isocitrate[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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* [[Tiso_gene_13007]]
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** EXPERIMENTAL_ANNOTATION
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***EC-NUMBER
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== Pathways  ==
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== Reconstruction information  ==
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* Category: [[manual]]
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** Source: [[manual-primary_network]]
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* Category: [[annotation]]
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** Source: [[annotation-experimental_annotation]]
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*** Tool: [[pathwaytools]]
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== External links  ==
 
== External links  ==
* LIGAND-RXN:
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* PUBCHEM:
** [http://www.genome.jp/dbget-bin/www_bget?R01324 R01324]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4615422 4615422]
{{#set: direction=REVERSIBLE}}
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* CHEMSPIDER:
{{#set: common name=Aconitate hydratase 2 (Aconitase)}}
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** [http://www.chemspider.com/Chemical-Structure.3806481.html 3806481]
{{#set: ec number=EC-4.2.1.3}}
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* HMDB : HMDB11635
{{#set: gene associated=Tiso_gene_13007}}
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{{#set: smiles=CC1(C=CC(=CC=1)OS(=O)(=O)[O-])}}
{{#set: in pathway=}}
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{{#set: common name=4-methylphenyl sulfate}}
{{#set: reconstruction category=manual|annotation}}
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{{#set: inchi key=InChIKey=WGNAKZGUSRVWRH-UHFFFAOYSA-M}}
{{#set: reconstruction source=manual-primary_network|annotation-experimental_annotation}}
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{{#set: molecular weight=187.19    }}
{{#set: reconstruction tool=pathwaytools}}
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{{#set: common name=p-cresol sulfate}}
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{{#set: reversible reaction associated=RXN-15588}}

Revision as of 15:44, 21 March 2018

Metabolite CPD-16819

  • smiles:
    • CC1(C=CC(=CC=1)OS(=O)(=O)[O-])
  • common name:
    • 4-methylphenyl sulfate
  • inchi key:
    • InChIKey=WGNAKZGUSRVWRH-UHFFFAOYSA-M
  • molecular weight:
    • 187.19
  • Synonym(s):
    • p-cresol sulfate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC1(C=CC(=CC=1)OS(=O)(=O)[O-])" cannot be used as a page name in this wiki.