Difference between revisions of "CPD-6242"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-11921 RXN-11921] == * direction: ** LEFT-TO-RIGHT * common name: ** 3-methylcrotonyl-CoA:acetyl...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-69 CPD-69] == * smiles: ** C([O-])#N * inchi key: ** InChIKey=XLJMAIOERFSOGZ-UHFFFAOYSA-M *...")
Line 1: Line 1:
−
[[Category:Reaction]]
+
[[Category:Metabolite]]
−
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-11921 RXN-11921] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-69 CPD-69] ==
−
* direction:
+
* smiles:
−
** LEFT-TO-RIGHT
+
** C([O-])#N
 +
* inchi key:
 +
** InChIKey=XLJMAIOERFSOGZ-UHFFFAOYSA-M
 
* common name:
 
* common name:
−
** 3-methylcrotonyl-CoA:acetyl-CoA C-acyltransferase
+
** cyanate
−
* ec number:
+
* molecular weight:
−
** [http://enzyme.expasy.org/EC/2.3.1 EC-2.3.1]
+
** 42.017   
 
* Synonym(s):
 
* Synonym(s):
−
** 5-methyl-3-oxo-4-hexenoyl-CoA thiolase
+
** cyanic acid
 +
** hydrogen cyanate
  
−
== Reaction Formula ==
+
== Reaction(s) known to consume the compound ==
−
* With identifiers:
+
== Reaction(s) known to produce the compound ==
−
** 1 [[CO-A]][c] '''+''' 1 [[CPD-12906]][c] '''=>''' 1 [[3-METHYL-CROTONYL-COA]][c] '''+''' 1 [[ACETYL-COA]][c]
+
* [[RXN-17753]]
−
* With common name(s):
+
== Reaction(s) of unknown directionality ==
−
** 1 coenzyme A[c] '''+''' 1 5-methyl-3-oxo-4-hexenoyl-CoA[c] '''=>''' 1 3-methylcrotonyl-CoA[c] '''+''' 1 acetyl-CoA[c]
+
−
 
+
−
== Genes associated with this reaction  ==
+
−
Genes have been associated with this reaction based on different elements listed below.
+
−
* [[Ec-26_003940]]
+
−
** [[pantograph]]-[[aragem]]
+
−
== Pathways  ==
+
−
* [[PWY-6672]], cis-genanyl-CoA degradation: [http://metacyc.org/META/NEW-IMAGE?object=PWY-6672 PWY-6672]
+
−
** '''4''' reactions found over '''9''' reactions in the full pathway
+
−
== Reconstruction information  ==
+
−
* [[orthology]]:
+
−
** [[pantograph]]:
+
−
*** [[aragem]]
+
 
== External links  ==
 
== External links  ==
−
* LIGAND-RXN:
+
* CAS : 420-05-3
−
** [http://www.genome.jp/dbget-bin/www_bget?R08095 R08095]
+
* BIGG : 37550
−
{{#set: direction=LEFT-TO-RIGHT}}
+
* PUBCHEM:
−
{{#set: common name=3-methylcrotonyl-CoA:acetyl-CoA C-acyltransferase}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=105034 105034]
−
{{#set: ec number=EC-2.3.1}}
+
* HMDB : HMDB02078
−
{{#set: common name=5-methyl-3-oxo-4-hexenoyl-CoA thiolase}}
+
* LIGAND-CPD:
−
{{#set: gene associated=Ec-26_003940}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C01417 C01417]
−
{{#set: in pathway=PWY-6672}}
+
* CHEMSPIDER:
−
{{#set: reconstruction category=orthology}}
+
** [http://www.chemspider.com/Chemical-Structure.10445868.html 10445868]
−
{{#set: reconstruction tool=pantograph}}
+
* CHEBI:
−
{{#set: reconstruction source=aragem}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29195 29195]
 +
* METABOLIGHTS : MTBLC29195
 +
{{#set: smiles=C([O-])#N}}
 +
{{#set: inchi key=InChIKey=XLJMAIOERFSOGZ-UHFFFAOYSA-M}}
 +
{{#set: common name=cyanate}}
 +
{{#set: molecular weight=42.017    }}
 +
{{#set: common name=cyanic acid|hydrogen cyanate}}
 +
{{#set: produced by=RXN-17753}}

Revision as of 20:50, 17 March 2018

Metabolite CPD-69

  • smiles:
    • C([O-])#N
  • inchi key:
    • InChIKey=XLJMAIOERFSOGZ-UHFFFAOYSA-M
  • common name:
    • cyanate
  • molecular weight:
    • 42.017
  • Synonym(s):
    • cyanic acid
    • hydrogen cyanate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 420-05-3
  • BIGG : 37550
  • PUBCHEM:
  • HMDB : HMDB02078
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC29195
"C([O-])#N" cannot be used as a page name in this wiki.



Retrieved from "http://gem-aureme.irisa.fr/ectogem/index.php?title=CPD-6242&oldid=10586"