Difference between revisions of "CPD-7066"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14728 RXN-14728] == * direction: ** REVERSIBLE * common name: ** amidase * ec number: ** [http:...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7066 CPD-7066] == * smiles: ** CC(C(=O)[O-])C(O)C([O-])=O * common name: ** (2R,3S)-3-methy...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14728 RXN-14728] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7066 CPD-7066] ==
* direction:
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* smiles:
** REVERSIBLE
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** CC(C(=O)[O-])C(O)C([O-])=O
 
* common name:
 
* common name:
** amidase
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** (2R,3S)-3-methylmalate
* ec number:
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* inchi key:
** [http://enzyme.expasy.org/EC/3.5.1.4 EC-3.5.1.4]
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** InChIKey=NPYQJIHHTGFBLN-STHAYSLISA-L
 +
* molecular weight:
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** 146.099   
 
* Synonym(s):
 
* Synonym(s):
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** D-erythro-3-methylmalate
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** erythro-β-methyl-D-malate
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** β-erythro-methylmalate
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** β-methyl-D-malate
  
== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
* With identifiers:
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* [[RXN-7745]]
** 1 [[WATER]][c] '''+''' 1 [[ACETAMIDE]][c] '''<=>''' 1 [[ACET]][c] '''+''' 1 [[AMMONIUM]][c]
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== Reaction(s) known to produce the compound ==
* With common name(s):
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== Reaction(s) of unknown directionality ==
** 1 H2O[c] '''+''' 1 acetamide[c] '''<=>''' 1 acetate[c] '''+''' 1 ammonium[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_13682]]
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** Source: [[annotation-in-silico_annotation]]
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*** Assignment: AUTOMATED-NAME-MATCH
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== Pathways  ==
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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]]
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== External links  ==
 
== External links  ==
* LIGAND-RXN:
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* PUBCHEM:
** [http://www.genome.jp/dbget-bin/www_bget?R00321 R00321]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45266666 45266666]
{{#set: direction=REVERSIBLE}}
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* CHEBI:
{{#set: common name=amidase}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58511 58511]
{{#set: ec number=EC-3.5.1.4}}
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* LIGAND-CPD:
{{#set: gene associated=Tiso_gene_13682}}
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** [http://www.genome.jp/dbget-bin/www_bget?C06029 C06029]
{{#set: in pathway=}}
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{{#set: smiles=CC(C(=O)[O-])C(O)C([O-])=O}}
{{#set: reconstruction category=annotation}}
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{{#set: common name=(2R,3S)-3-methylmalate}}
{{#set: reconstruction source=annotation-in-silico_annotation}}
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{{#set: inchi key=InChIKey=NPYQJIHHTGFBLN-STHAYSLISA-L}}
{{#set: reconstruction tool=pathwaytools}}
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{{#set: molecular weight=146.099    }}
 +
{{#set: common name=D-erythro-3-methylmalate|erythro-&beta;-methyl-D-malate|&beta;-erythro-methylmalate|&beta;-methyl-D-malate}}
 +
{{#set: consumed by=RXN-7745}}

Latest revision as of 20:03, 21 March 2018

Metabolite CPD-7066

  • smiles:
    • CC(C(=O)[O-])C(O)C([O-])=O
  • common name:
    • (2R,3S)-3-methylmalate
  • inchi key:
    • InChIKey=NPYQJIHHTGFBLN-STHAYSLISA-L
  • molecular weight:
    • 146.099
  • Synonym(s):
    • D-erythro-3-methylmalate
    • erythro-β-methyl-D-malate
    • β-erythro-methylmalate
    • β-methyl-D-malate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

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