Difference between revisions of "CPD-2750"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=MEPROPCOA-FAD-RXN MEPROPCOA-FAD-RXN] == * direction: ** LEFT-TO-RIGHT * common name: ** isobutyryl-...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-2750 CPD-2750] == * smiles: ** C1(=O)(C(O)C[CH](N(C)1)C2(C=NC=CC=2)) * common name: ** tran...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=MEPROPCOA-FAD-RXN MEPROPCOA-FAD-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-2750 CPD-2750] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** C1(=O)(C(O)C[CH](N(C)1)C2(C=NC=CC=2))
 
* common name:
 
* common name:
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** isobutyryl-CoA dehydrogenase
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** trans-3'-hydroxycotinine
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* ec number:
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* inchi key:
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** [http://enzyme.expasy.org/EC/1.3.8 EC-1.3.8]
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** InChIKey=XOKCJXZZNAUIQN-DTWKUNHWSA-N
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* molecular weight:
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** 192.217   
 
* Synonym(s):
 
* Synonym(s):
  
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== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
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* With identifiers:
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* [[RXN66-162]]
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** 1 [[FAD]][c] '''+''' 1 [[PROTON]][c] '''+''' 1 [[ISOBUTYRYL-COA]][c] '''=>''' 1 [[METHACRYLYL-COA]][c] '''+''' 1 [[FADH2]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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* [[RXN66-161]]
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** 1 FAD[c] '''+''' 1 H+[c] '''+''' 1 isobutanoyl-CoA[c] '''=>''' 1 methylacrylyl-CoA[c] '''+''' 1 FADH2[c]
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== Reaction(s) of unknown directionality ==
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== Genes associated with this reaction  ==
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== Pathways  ==
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* [[VALDEG-PWY]], L-valine degradation I: [http://metacyc.org/META/NEW-IMAGE?object=VALDEG-PWY VALDEG-PWY]
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** '''8''' reactions found over '''8''' reactions in the full pathway
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== Reconstruction information  ==
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* Category: [[annotation]]
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** Source: [[annotation-experimental_annotation]]
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*** Tool: [[pathwaytools]]
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** Source: [[annotation-in-silico_annotation]]
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*** Tool: [[pathwaytools]]
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== External links  ==
 
== External links  ==
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* RHEA:
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* PUBCHEM:
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=31098 31098]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=107963 107963]
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* LIGAND-RXN:
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* CHEMSPIDER:
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** [http://www.genome.jp/dbget-bin/www_bget?R02661 R02661]
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** [http://www.chemspider.com/Chemical-Structure.97080.html 97080]
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{{#set: direction=LEFT-TO-RIGHT}}
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* CHEBI:
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{{#set: common name=isobutyryl-CoA dehydrogenase}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=71182 71182]
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{{#set: ec number=EC-1.3.8}}
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* METABOLIGHTS : MTBLC71182
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{{#set: in pathway=VALDEG-PWY}}
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* HMDB : HMDB01390
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{{#set: reconstruction category=annotation}}
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{{#set: smiles=C1(=O)(C(O)C[CH](N(C)1)C2(C=NC=CC=2))}}
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{{#set: reconstruction source=annotation-experimental_annotation|annotation-in-silico_annotation}}
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{{#set: common name=trans-3'-hydroxycotinine}}
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: inchi key=InChIKey=XOKCJXZZNAUIQN-DTWKUNHWSA-N}}
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{{#set: molecular weight=192.217    }}
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{{#set: consumed by=RXN66-162}}
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{{#set: produced by=RXN66-161}}

Latest revision as of 20:23, 21 March 2018

Metabolite CPD-2750

  • smiles:
    • C1(=O)(C(O)C[CH](N(C)1)C2(C=NC=CC=2))
  • common name:
    • trans-3'-hydroxycotinine
  • inchi key:
    • InChIKey=XOKCJXZZNAUIQN-DTWKUNHWSA-N
  • molecular weight:
    • 192.217
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • PUBCHEM:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC71182
  • HMDB : HMDB01390
"C1(=O)(C(O)C[CH](N(C)1)C2(C=NC=CC=2))" cannot be used as a page name in this wiki.



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