Difference between revisions of "2K-4CH3-PENTANOATE"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=ACYLPHOSPHATASE-RXN ACYLPHOSPHATASE-RXN] == * direction: ** LEFT-TO-RIGHT * common name: ** acylpho...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2K-4CH3-PENTANOATE 2K-4CH3-PENTANOATE] == * smiles: ** CC(C)CC(C([O-])=O)=O * common name: ** 4...")
 
(3 intermediate revisions by the same user not shown)
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=ACYLPHOSPHATASE-RXN ACYLPHOSPHATASE-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2K-4CH3-PENTANOATE 2K-4CH3-PENTANOATE] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CC(C)CC(C([O-])=O)=O
 
* common name:
 
* common name:
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** acylphosphatase
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** 4-methyl-2-oxopentanoate
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* ec number:
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* inchi key:
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** [http://enzyme.expasy.org/EC/3.6.1.7 EC-3.6.1.7]
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** InChIKey=BKAJNAXTPSGJCU-UHFFFAOYSA-M
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* molecular weight:
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** 129.135   
 
* Synonym(s):
 
* Synonym(s):
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** 2-keto-4-methyl-pentanoate
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** 2-oxoisocaproate
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** 2-oxo-4-methylpentanoate
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** α-ketoisocaproate
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** α-oxoisocaproate
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** 2-ketoisocaproate
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** ketoleucine
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** 4-methyl-2-oxopentanoic acid
  
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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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* [[KETOISOCAPROATE-RXN]]
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** 1 [[Acyl-Phosphates]][c] '''+''' 1 [[WATER]][c] '''=>''' 1 [[Carboxylates]][c] '''+''' 1 [[Pi]][c] '''+''' 1 [[PROTON]][c]
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* [[2KETO-4METHYL-PENTANOATE-DEHYDROG-RXN]]
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* With common name(s):
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== Reaction(s) known to produce the compound ==
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** 1 an acyl phosphate[c] '''+''' 1 H2O[c] '''=>''' 1 a carboxylate[c] '''+''' 1 phosphate[c] '''+''' 1 H+[c]
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* [[RXN-7800]]
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* [[RXN-13158]]
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== Genes associated with this reaction  ==
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== Reaction(s) of unknown directionality ==
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Genes have been associated with this reaction based on different elements listed below.
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* [[BRANCHED-CHAINAMINOTRANSFERLEU-RXN]]
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* [[Tiso_gene_13909]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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== Pathways  ==
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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 : 816-66-0
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=14965 14965]
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* BIGG : 4mop
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* LIGAND-RXN:
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* PUBCHEM:
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** [http://www.genome.jp/dbget-bin/www_bget?R00539 R00539]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=3527278 3527278]
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* UNIPROT:
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* HMDB : HMDB00695
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** [http://www.uniprot.org/uniprot/P14620 P14620]
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* LIGAND-CPD:
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** [http://www.uniprot.org/uniprot/P35745 P35745]
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** [http://www.genome.jp/dbget-bin/www_bget?C00233 C00233]
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** [http://www.uniprot.org/uniprot/P41500 P41500]
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* CHEMSPIDER:
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** [http://www.uniprot.org/uniprot/Q9CHW2 Q9CHW2]
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** [http://www.chemspider.com/Chemical-Structure.2766269.html 2766269]
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** [http://www.uniprot.org/uniprot/P0AB65 P0AB65]
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* CHEBI:
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** [http://www.uniprot.org/uniprot/P07033 P07033]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17865 17865]
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** [http://www.uniprot.org/uniprot/P07031 P07031]
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* METABOLIGHTS : MTBLC17865
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** [http://www.uniprot.org/uniprot/P07032 P07032]
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{{#set: smiles=CC(C)CC(C([O-])=O)=O}}
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** [http://www.uniprot.org/uniprot/P35744 P35744]
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{{#set: common name=4-methyl-2-oxopentanoate}}
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** [http://www.uniprot.org/uniprot/P00818 P00818]
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{{#set: inchi key=InChIKey=BKAJNAXTPSGJCU-UHFFFAOYSA-M}}
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** [http://www.uniprot.org/uniprot/P07311 P07311]
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{{#set: molecular weight=129.135    }}
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** [http://www.uniprot.org/uniprot/P00819 P00819]
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{{#set: common name=2-keto-4-methyl-pentanoate|2-oxoisocaproate|2-oxo-4-methylpentanoate|α-ketoisocaproate|α-oxoisocaproate|2-ketoisocaproate|ketoleucine|4-methyl-2-oxopentanoic acid}}
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** [http://www.uniprot.org/uniprot/P00820 P00820]
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{{#set: consumed by=KETOISOCAPROATE-RXN|2KETO-4METHYL-PENTANOATE-DEHYDROG-RXN}}
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** [http://www.uniprot.org/uniprot/P00821 P00821]
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{{#set: produced by=RXN-7800|RXN-13158}}
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** [http://www.uniprot.org/uniprot/P14621 P14621]
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{{#set: reversible reaction associated=BRANCHED-CHAINAMINOTRANSFERLEU-RXN}}
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{{#set: direction=LEFT-TO-RIGHT}}
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{{#set: common name=acylphosphatase}}
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{{#set: ec number=EC-3.6.1.7}}
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{{#set: gene associated=Tiso_gene_13909}}
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{{#set: in pathway=}}
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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 20:22, 21 March 2018

Metabolite 2K-4CH3-PENTANOATE

  • smiles:
    • CC(C)CC(C([O-])=O)=O
  • common name:
    • 4-methyl-2-oxopentanoate
  • inchi key:
    • InChIKey=BKAJNAXTPSGJCU-UHFFFAOYSA-M
  • molecular weight:
    • 129.135
  • Synonym(s):
    • 2-keto-4-methyl-pentanoate
    • 2-oxoisocaproate
    • 2-oxo-4-methylpentanoate
    • α-ketoisocaproate
    • α-oxoisocaproate
    • 2-ketoisocaproate
    • ketoleucine
    • 4-methyl-2-oxopentanoic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 816-66-0
  • BIGG : 4mop
  • PUBCHEM:
  • HMDB : HMDB00695
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC17865
"CC(C)CC(C([O-])=O)=O" cannot be used as a page name in this wiki.




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