Difference between revisions of "IMIDAZOLE ACETALDEHYDE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BUTYRIC_ACID BUTYRIC_ACID] == * smiles: ** CCCC(=O)[O-] * common name: ** butanoate * inchi key...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=IMIDAZOLE_ACETALDEHYDE IMIDAZOLE_ACETALDEHYDE] == * smiles: ** C1(NC=NC(CC=O)=1) * common name:...")
 
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BUTYRIC_ACID BUTYRIC_ACID] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=IMIDAZOLE_ACETALDEHYDE IMIDAZOLE_ACETALDEHYDE] ==
 
* smiles:
 
* smiles:
** CCCC(=O)[O-]
+
** C1(NC=NC(CC=O)=1)
 
* common name:
 
* common name:
** butanoate
+
** imidazole acetaldehyde
 
* inchi key:
 
* inchi key:
** InChIKey=FERIUCNNQQJTOY-UHFFFAOYSA-M
+
** InChIKey=MQSRGWNVEZRLDK-UHFFFAOYSA-N
 
* molecular weight:
 
* molecular weight:
** 87.098    
+
** 110.115    
 
* Synonym(s):
 
* Synonym(s):
** butyrate
+
** (imidazol-4-yl)acetaldehyde
** butyric acid
+
** butanoic acid
+
** ethylacetic acid
+
** n-butanoate
+
** 1-propanecarboxylic acid
+
** propylformic acid
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[ALDH_im4ac]]
 +
* [[RXN-10089]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-12086]]
+
* [[RXN-9600]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
* UM-BBD-CPD : c0035
 
* CAS : 107-92-6
 
* BIGG : but
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=104775 104775]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=150841 150841]
* HMDB : HMDB00039
+
* HMDB : HMDB03905
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C00246 C00246]
+
** [http://www.genome.jp/dbget-bin/www_bget?C05130 C05130]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.94582.html 94582]
+
** [http://www.chemspider.com/Chemical-Structure.11271820.html 11271820]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17968 17968]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=27398 27398]
* METABOLIGHTS : MTBLC17968
+
* METABOLIGHTS : MTBLC27398
{{#set: smiles=CCCC(=O)[O-]}}
+
{{#set: smiles=C1(NC=NC(CC=O)=1)}}
{{#set: common name=butanoate}}
+
{{#set: common name=imidazole acetaldehyde}}
{{#set: inchi key=InChIKey=FERIUCNNQQJTOY-UHFFFAOYSA-M}}
+
{{#set: inchi key=InChIKey=MQSRGWNVEZRLDK-UHFFFAOYSA-N}}
{{#set: molecular weight=87.098   }}
+
{{#set: molecular weight=110.115   }}
{{#set: common name=butyrate|butyric acid|butanoic acid|ethylacetic acid|n-butanoate|1-propanecarboxylic acid|propylformic acid}}
+
{{#set: common name=(imidazol-4-yl)acetaldehyde}}
{{#set: produced by=RXN-12086}}
+
{{#set: consumed by=ALDH_im4ac|RXN-10089}}
 +
{{#set: produced by=RXN-9600}}

Latest revision as of 20:11, 21 March 2018

Metabolite IMIDAZOLE_ACETALDEHYDE

  • smiles:
    • C1(NC=NC(CC=O)=1)
  • common name:
    • imidazole acetaldehyde
  • inchi key:
    • InChIKey=MQSRGWNVEZRLDK-UHFFFAOYSA-N
  • molecular weight:
    • 110.115
  • Synonym(s):
    • (imidazol-4-yl)acetaldehyde

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links