Difference between revisions of "GLC-D-LACTONE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=NN-DIMETHYLANILINE-N-OXIDE NN-DIMETHYLANILINE-N-OXIDE] == * smiles: ** CN(C)(=O)C1(C=CC=CC=1) *...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-396 CPD-396] == * smiles: ** C[N+]1(=CC=CC(=C1)C(=O)N) * inchi key: ** InChIKey=LDHMAVIPBRS...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=NN-DIMETHYLANILINE-N-OXIDE NN-DIMETHYLANILINE-N-OXIDE] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-396 CPD-396] ==
 
* smiles:
 
* smiles:
** CN(C)(=O)C1(C=CC=CC=1)
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** C[N+]1(=CC=CC(=C1)C(=O)N)
 
* inchi key:
 
* inchi key:
** InChIKey=LKQUDAOAMBKKQW-UHFFFAOYSA-N
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** InChIKey=LDHMAVIPBRSVRG-UHFFFAOYSA-O
 
* common name:
 
* common name:
** N,N-dimethylaniline-N-oxide
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** 1-methylnicotinamide
 
* molecular weight:
 
* molecular weight:
** 137.181    
+
** 137.161    
 
* Synonym(s):
 
* Synonym(s):
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[1.14.13.8-RXN]]
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* [[NICOTINAMIDE-N-METHYLTRANSFERASE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=950 950]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=457 457]
 +
* HMDB : HMDB00699
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C02918 C02918]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.925.html 925]
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** [http://www.chemspider.com/Chemical-Structure.444.html 444]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17735 17735]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16797 16797]
* LIGAND-CPD:
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* METABOLIGHTS : MTBLC16797
** [http://www.genome.jp/dbget-bin/www_bget?C01183 C01183]
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{{#set: smiles=C[N+]1(=CC=CC(=C1)C(=O)N)}}
* HMDB : HMDB01466
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{{#set: inchi key=InChIKey=LDHMAVIPBRSVRG-UHFFFAOYSA-O}}
{{#set: smiles=CN(C)(=O)C1(C=CC=CC=1)}}
+
{{#set: common name=1-methylnicotinamide}}
{{#set: inchi key=InChIKey=LKQUDAOAMBKKQW-UHFFFAOYSA-N}}
+
{{#set: molecular weight=137.161   }}
{{#set: common name=N,N-dimethylaniline-N-oxide}}
+
{{#set: produced by=NICOTINAMIDE-N-METHYLTRANSFERASE-RXN}}
{{#set: molecular weight=137.181   }}
+
{{#set: produced by=1.14.13.8-RXN}}
+

Revision as of 18:17, 10 January 2018

Metabolite CPD-396

  • smiles:
    • C[N+]1(=CC=CC(=C1)C(=O)N)
  • inchi key:
    • InChIKey=LDHMAVIPBRSVRG-UHFFFAOYSA-O
  • common name:
    • 1-methylnicotinamide
  • molecular weight:
    • 137.161
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • PUBCHEM:
  • HMDB : HMDB00699
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC16797
"C[N+]1(=CC=CC(=C1)C(=O)N)" cannot be used as a page name in this wiki.