Difference between revisions of "CH3-MALONATE-S-ALD"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=THYROXINE-DEIODINASE-RXN THYROXINE-DEIODINASE-RXN] == * direction: ** LEFT-TO-RIGHT * common name:...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CH3-MALONATE-S-ALD CH3-MALONATE-S-ALD] == * smiles: ** CC([CH]=O)C(=O)[O-] * common name: ** (S...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=THYROXINE-DEIODINASE-RXN THYROXINE-DEIODINASE-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CH3-MALONATE-S-ALD CH3-MALONATE-S-ALD] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CC([CH]=O)C(=O)[O-]
 
* common name:
 
* common name:
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** type_i_iodothyronine_deiodinase
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** (S)-methylmalonate-semialdehyde
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* ec number:
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* inchi key:
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** [http://enzyme.expasy.org/EC/1.21.99.4 EC-1.21.99.4]
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** InChIKey=VOKUMXABRRXHAR-VKHMYHEASA-M
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* molecular weight:
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** 101.082   
 
* Synonym(s):
 
* Synonym(s):
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** (S)-2-methyl-3-oxopropanoate
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** (S)-ch3-malonate-semialdehyde
  
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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-11213]]
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** 1 [[Donor-H2]][c] '''+''' 1 [[L-THYROXINE]][c] '''=>''' 1 [[Acceptor]][c] '''+''' 1 [[PROTON]][c] '''+''' 1 [[LIOTHYRONINE]][c] '''+''' 1 [[CPD-387]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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* [[3-HYDROXYISOBUTYRATE-DEHYDROGENASE-RXN]]
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** 1 a reduced electron acceptor[c] '''+''' 1 L-thyroxine[c] '''=>''' 1 an oxidized electron acceptor[c] '''+''' 1 H+[c] '''+''' 1 3,5,3'-triiodo-L-thyronine[c] '''+''' 1 iodide[c]
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== Reaction(s) of unknown directionality ==
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* [[2.6.1.22-RXN]]
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== Genes associated with this reaction  ==
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* [[RXN-14056]]
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Genes have been associated with this reaction based on different elements listed below.
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* [[Tiso_gene_20481]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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== Pathways  ==
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* [[PWY-6261]], thyroid hormone metabolism II (via conjugation and/or degradation): [http://metacyc.org/META/NEW-IMAGE?object=PWY-6261 PWY-6261]
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** '''11''' reactions found over '''15''' reactions in the full pathway
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* [[PWY-6260]], thyroid hormone metabolism I (via deiodination): [http://metacyc.org/META/NEW-IMAGE?object=PWY-6260 PWY-6260]
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** '''3''' reactions found over '''12''' reactions in the full pathway
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== Reconstruction information  ==
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* [[annotation]]:
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** [[pathwaytools]]:
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*** [[in-silico_annotation]]
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== External links  ==
 
== External links  ==
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* RHEA:
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* CAS : 6236-08-4
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=19745 19745]
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* PUBCHEM:
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* LIGAND-RXN:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=46173457 46173457]
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** [http://www.genome.jp/dbget-bin/www_bget?R03734 R03734]
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* HMDB : HMDB02217
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* UNIPROT:
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* LIGAND-CPD:
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** [http://www.uniprot.org/uniprot/P21195 P21195]
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** [http://www.genome.jp/dbget-bin/www_bget?C06002 C06002]
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** [http://www.uniprot.org/uniprot/P49897 P49897]
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* CHEBI:
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** [http://www.uniprot.org/uniprot/P49898 P49898]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62413 62413]
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** [http://www.uniprot.org/uniprot/P05307 P05307]
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* METABOLIGHTS : MTBLC62413
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** [http://www.uniprot.org/uniprot/P09102 P09102]
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{{#set: smiles=CC([CH]=O)C(=O)[O-]}}
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** [http://www.uniprot.org/uniprot/P07237 P07237]
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{{#set: common name=(S)-methylmalonate-semialdehyde}}
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** [http://www.uniprot.org/uniprot/Q922C8 Q922C8]
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{{#set: inchi key=InChIKey=VOKUMXABRRXHAR-VKHMYHEASA-M}}
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** [http://www.uniprot.org/uniprot/P04785 P04785]
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{{#set: molecular weight=101.082    }}
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** [http://www.uniprot.org/uniprot/P24389 P24389]
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{{#set: common name=(S)-2-methyl-3-oxopropanoate|(S)-ch3-malonate-semialdehyde}}
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{{#set: direction=LEFT-TO-RIGHT}}
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{{#set: consumed by=RXN-11213}}
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{{#set: common name=type_i_iodothyronine_deiodinase}}
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{{#set: produced by=3-HYDROXYISOBUTYRATE-DEHYDROGENASE-RXN}}
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{{#set: ec number=EC-1.21.99.4}}
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{{#set: reversible reaction associated=2.6.1.22-RXN|RXN-14056}}
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{{#set: gene associated=Tiso_gene_20481}}
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{{#set: in pathway=PWY-6261|PWY-6260}}
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{{#set: reconstruction category=annotation}}
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: reconstruction source=in-silico_annotation}}
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Latest revision as of 20:25, 21 March 2018

Metabolite CH3-MALONATE-S-ALD

  • smiles:
    • CC([CH]=O)C(=O)[O-]
  • common name:
    • (S)-methylmalonate-semialdehyde
  • inchi key:
    • InChIKey=VOKUMXABRRXHAR-VKHMYHEASA-M
  • molecular weight:
    • 101.082
  • Synonym(s):
    • (S)-2-methyl-3-oxopropanoate
    • (S)-ch3-malonate-semialdehyde

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 6236-08-4
  • PUBCHEM:
  • HMDB : HMDB02217
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC62413
"CC([CH]=O)C(=O)[O-" cannot be used as a page name in this wiki.




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