Difference between revisions of "BETAINE ALDEHYDE"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN0-3962 RXN0-3962] == * direction: ** LEFT-TO-RIGHT * ec number: ** [http://enzyme.expasy.org/EC/...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BETAINE_ALDEHYDE BETAINE_ALDEHYDE] == * smiles: ** C[N+](C)(C[CH]=O)C * common name: ** betaine...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN0-3962 RXN0-3962] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BETAINE_ALDEHYDE BETAINE_ALDEHYDE] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** C[N+](C)(C[CH]=O)C
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* ec number:
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* common name:
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** [http://enzyme.expasy.org/EC/1.2.1.4 EC-1.2.1.4]
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** betaine aldehyde
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* inchi key:
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** InChIKey=SXKNCCSPZDCRFD-UHFFFAOYSA-N
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* molecular weight:
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** 102.156   
 
* Synonym(s):
 
* Synonym(s):
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** glycine betaine aldehyde
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** N,N,N-trimethyl-2-oxoethylammonium
  
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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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* [[RXN-17758]]
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** 1 [[WATER]][c] '''+''' 1 [[ACETALD]][c] '''+''' 1 [[NADP]][c] '''=>''' 2 [[PROTON]][c] '''+''' 1 [[ACET]][c] '''+''' 1 [[NADPH]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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* [[RXN0-7230]]
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** 1 H2O[c] '''+''' 1 acetaldehyde[c] '''+''' 1 NADP+[c] '''=>''' 2 H+[c] '''+''' 1 acetate[c] '''+''' 1 NADPH[c]
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== Reaction(s) of unknown directionality ==
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* [[BADH-RXN]]
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== Genes associated with this reaction  ==
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* [[CHD-RXN]]
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== Pathways  ==
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* [[RXN-6268]]
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* [[PWY-5768]], pyruvate fermentation to acetate VIII: [http://metacyc.org/META/NEW-IMAGE?object=PWY-5768 PWY-5768]
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** '''1''' reactions found over '''2''' reactions in the full pathway
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* [[PWY-7268]], NAD/NADP-NADH/NADPH cytosolic interconversion (yeast): [http://metacyc.org/META/NEW-IMAGE?object=PWY-7268 PWY-7268]
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** '''4''' reactions found over '''5''' 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]]
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== External links  ==
 
== External links  ==
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* RHEA:
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* CAS : 7418-61-3
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=25298 25298]
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* BIGG : betald
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* LIGAND-RXN:
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* DRUGBANK : DB04401
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** [http://www.genome.jp/dbget-bin/www_bget?R00711 R00711]
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* PUBCHEM:
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{{#set: direction=LEFT-TO-RIGHT}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=249 249]
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{{#set: ec number=EC-1.2.1.4}}
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* HMDB : HMDB01252
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{{#set: in pathway=PWY-5768|PWY-7268}}
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* LIGAND-CPD:
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{{#set: reconstruction category=annotation}}
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** [http://www.genome.jp/dbget-bin/www_bget?C00576 C00576]
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{{#set: reconstruction source=annotation-in-silico_annotation}}
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* CHEMSPIDER:
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{{#set: reconstruction tool=pathwaytools}}
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** [http://www.chemspider.com/Chemical-Structure.244.html 244]
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* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15710 15710]
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* METABOLIGHTS : MTBLC15710
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{{#set: smiles=C[N+](C)(C[CH]=O)C}}
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{{#set: common name=betaine aldehyde}}
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{{#set: inchi key=InChIKey=SXKNCCSPZDCRFD-UHFFFAOYSA-N}}
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{{#set: molecular weight=102.156    }}
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{{#set: common name=glycine betaine aldehyde|N,N,N-trimethyl-2-oxoethylammonium}}
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{{#set: consumed by=RXN-17758}}
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{{#set: produced by=RXN0-7230}}
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{{#set: reversible reaction associated=BADH-RXN|CHD-RXN|RXN-6268}}

Latest revision as of 20:30, 21 March 2018

Metabolite BETAINE_ALDEHYDE

  • smiles:
    • C[N+](C)(C[CH]=O)C
  • common name:
    • betaine aldehyde
  • inchi key:
    • InChIKey=SXKNCCSPZDCRFD-UHFFFAOYSA-N
  • molecular weight:
    • 102.156
  • Synonym(s):
    • glycine betaine aldehyde
    • N,N,N-trimethyl-2-oxoethylammonium

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 7418-61-3
  • BIGG : betald
  • DRUGBANK : DB04401
  • PUBCHEM:
  • HMDB : HMDB01252
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC15710
"C[N+](C)(C[CH]=O)C" cannot be used as a page name in this wiki.




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