Difference between revisions of "CPD-14274"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14199 RXN-14199] == * direction: ** LEFT-TO-RIGHT * common name: ** ORF * ec number: ** [http:/...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BUTYRYL-COA BUTYRYL-COA] == * smiles: ** CCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC...")
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[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14199 RXN-14199] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BUTYRYL-COA BUTYRYL-COA] ==
* direction:
+
* smiles:
** LEFT-TO-RIGHT
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** CCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]
 
* common name:
 
* common name:
** ORF
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** butanoyl-CoA
* ec number:
+
* inchi key:
** [http://enzyme.expasy.org/EC/3.6.1.5 EC-3.6.1.5]
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** InChIKey=CRFNGMNYKDXRTN-HDRJHVAISA-J
 +
* molecular weight:
 +
** 833.593   
 
* Synonym(s):
 
* Synonym(s):
 +
** butyryl-CoA
 +
** butyryl-coenzyme A
  
== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
* With identifiers:
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* [[RXN-12565]]
** 1 [[DUTP]][c] '''+''' 2 [[WATER]][c] '''=>''' 2 [[PROTON]][c] '''+''' 2 [[Pi]][c] '''+''' 1 [[DUMP]][c]
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* [[ACOA40or]]
* With common name(s):
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== Reaction(s) known to produce the compound ==
** 1 dUTP[c] '''+''' 2 H2O[c] '''=>''' 2 H+[c] '''+''' 2 phosphate[c] '''+''' 1 dUMP[c]
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* [[BNorh]]
 
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* [[BNor]]
== Genes associated with this reaction  ==
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== Reaction(s) of unknown directionality ==
Genes have been associated with this reaction based on different elements listed below.
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* [[RXN-14193]]
* [[Tiso_gene_12899]]
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* [[BCor]]
** IN-SILICO_ANNOTATION
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***EC-NUMBER
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** EXPERIMENTAL_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_20236]]
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** [[pantograph]]-[[esiliculosus]]
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== Pathways  ==
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== Reconstruction information  ==
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* Category: [[orthology]]
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** Source: [[orthology-esiliculosus]]
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*** Tool: [[pantograph]]
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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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** Source: [[annotation-experimental_annotation]]
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*** Tool: [[pathwaytools]]
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== External links  ==
 
== External links  ==
{{#set: direction=LEFT-TO-RIGHT}}
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* UM-BBD-CPD : c0023
{{#set: common name=ORF}}
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* CAS : 2140-48-9
{{#set: ec number=EC-3.6.1.5}}
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* BIGG : btcoa
{{#set: gene associated=Tiso_gene_12899|Tiso_gene_20236}}
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* PUBCHEM:
{{#set: in pathway=}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25244513 25244513]
{{#set: reconstruction category=orthology|annotation}}
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* HMDB : HMDB01088
{{#set: reconstruction source=annotation-in-silico_annotation|annotation-experimental_annotation|orthology-esiliculosus}}
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* LIGAND-CPD:
{{#set: reconstruction tool=pantograph|pathwaytools}}
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** [http://www.genome.jp/dbget-bin/www_bget?C00136 C00136]
 +
* CHEBI:
 +
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57371 57371]
 +
* METABOLIGHTS : MTBLC57371
 +
{{#set: smiles=CCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]}}
 +
{{#set: common name=butanoyl-CoA}}
 +
{{#set: inchi key=InChIKey=CRFNGMNYKDXRTN-HDRJHVAISA-J}}
 +
{{#set: molecular weight=833.593    }}
 +
{{#set: common name=butyryl-CoA|butyryl-coenzyme A}}
 +
{{#set: consumed by=RXN-12565|ACOA40or}}
 +
{{#set: produced by=BNorh|BNor}}
 +
{{#set: reversible reaction associated=RXN-14193|BCor}}

Revision as of 16:27, 21 March 2018

Metabolite BUTYRYL-COA

  • smiles:
    • CCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]
  • common name:
    • butanoyl-CoA
  • inchi key:
    • InChIKey=CRFNGMNYKDXRTN-HDRJHVAISA-J
  • molecular weight:
    • 833.593
  • Synonym(s):
    • butyryl-CoA
    • butyryl-coenzyme A

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • UM-BBD-CPD : c0023
  • CAS : 2140-48-9
  • BIGG : btcoa
  • PUBCHEM:
  • HMDB : HMDB01088
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC57371
"CCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-" cannot be used as a page name in this wiki.