Difference between revisions of "CPD-2742"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-2742 CPD-2742] == * smiles: ** C1(=O)(CC[CH](N(C)1)C2(C=NC=CC=2)) * common name: ** cotinin...")
 
 
Line 3: Line 3:
 
* smiles:
 
* smiles:
 
** C1(=O)(CC[CH](N(C)1)C2(C=NC=CC=2))
 
** C1(=O)(CC[CH](N(C)1)C2(C=NC=CC=2))
* common name:
 
** cotinine
 
* inchi key:
 
** InChIKey=UIKROCXWUNQSPJ-VIFPVBQESA-N
 
 
* molecular weight:
 
* molecular weight:
 
** 176.218     
 
** 176.218     
 +
* inchi key:
 +
** InChIKey=UIKROCXWUNQSPJ-VIFPVBQESA-N
 +
* common name:
 +
** cotinine
 
* Synonym(s):
 
* Synonym(s):
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
* [[RXN66-169]]
 
* [[RXN66-169]]
 +
* [[RXN66-163]]
 
* [[RXN66-161]]
 
* [[RXN66-161]]
 
* [[RXN66-168]]
 
* [[RXN66-168]]
* [[RXN66-163]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
* PUBCHEM:
 
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=854019 854019]
 
 
* CHEMSPIDER:
 
* CHEMSPIDER:
 
** [http://www.chemspider.com/Chemical-Structure.746405.html 746405]
 
** [http://www.chemspider.com/Chemical-Structure.746405.html 746405]
 +
* REFMET : Cotinine
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=854019 854019]
 
* CHEBI:
 
* CHEBI:
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=68641 68641]
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=68641 68641]
* METABOLIGHTS : MTBLC68641
 
 
* HMDB : HMDB01046
 
* HMDB : HMDB01046
 +
* METABOLIGHTS : MTBLC68641
 
{{#set: smiles=C1(=O)(CC[CH](N(C)1)C2(C=NC=CC=2))}}
 
{{#set: smiles=C1(=O)(CC[CH](N(C)1)C2(C=NC=CC=2))}}
{{#set: common name=cotinine}}
 
{{#set: inchi key=InChIKey=UIKROCXWUNQSPJ-VIFPVBQESA-N}}
 
 
{{#set: molecular weight=176.218    }}
 
{{#set: molecular weight=176.218    }}
{{#set: consumed by=RXN66-169|RXN66-161|RXN66-168|RXN66-163}}
+
{{#set: inchi key=InChIKey=UIKROCXWUNQSPJ-VIFPVBQESA-N}}
 +
{{#set: common name=cotinine}}
 +
{{#set: consumed by=RXN66-169|RXN66-163|RXN66-161|RXN66-168}}

Latest revision as of 14:35, 10 January 2019

Metabolite CPD-2742

  • smiles:
    • C1(=O)(CC[CH](N(C)1)C2(C=NC=CC=2))
  • molecular weight:
    • 176.218
  • inchi key:
    • InChIKey=UIKROCXWUNQSPJ-VIFPVBQESA-N
  • common name:
    • cotinine
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CHEMSPIDER:
  • REFMET : Cotinine
  • PUBCHEM:
  • CHEBI:
  • HMDB : HMDB01046
  • METABOLIGHTS : MTBLC68641
"C1(=O)(CC[CH](N(C)1)C2(C=NC=CC=2))" cannot be used as a page name in this wiki.