Difference between revisions of "PWY-7277"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3483 CPD-3483] == * smiles: ** CC([N+]C(C)(C)CO)C(=O)C1(C=CC=C(Cl)C=1) * inchi key: ** InCh...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HISTIDINAL HISTIDINAL] == * smiles: ** C1(NC=NC=1CC([CH]=O)[N+]) * inchi key: ** InChIKey=VYOIE...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3483 CPD-3483] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HISTIDINAL HISTIDINAL] ==
 
* smiles:
 
* smiles:
** CC([N+]C(C)(C)CO)C(=O)C1(C=CC=C(Cl)C=1)
+
** C1(NC=NC=1CC([CH]=O)[N+])
 
* inchi key:
 
* inchi key:
** InChIKey=AKOAEVOSDHIVFX-UHFFFAOYSA-O
+
** InChIKey=VYOIELONWKIZJS-YFKPBYRVSA-O
 
* common name:
 
* common name:
** hydroxybupropion
+
** histidinal
 
* molecular weight:
 
* molecular weight:
** 256.752    
+
** 140.164    
 
* Synonym(s):
 
* Synonym(s):
 +
** L-histidinal
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[HISTALDEHYD-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN66-181]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[HISTOLDEHYD-RXN]]
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25202442 25202442]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=57339283 57339283]
* HMDB : HMDB12235
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* CHEBI:
{{#set: smiles=CC([N+]C(C)(C)CO)C(=O)C1(C=CC=C(Cl)C=1)}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=64802 64802]
{{#set: inchi key=InChIKey=AKOAEVOSDHIVFX-UHFFFAOYSA-O}}
+
* LIGAND-CPD:
{{#set: common name=hydroxybupropion}}
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** [http://www.genome.jp/dbget-bin/www_bget?C01929 C01929]
{{#set: molecular weight=256.752   }}
+
* HMDB : HMDB12234
{{#set: produced by=RXN66-181}}
+
{{#set: smiles=C1(NC=NC=1CC([CH]=O)[N+])}}
 +
{{#set: inchi key=InChIKey=VYOIELONWKIZJS-YFKPBYRVSA-O}}
 +
{{#set: common name=histidinal}}
 +
{{#set: molecular weight=140.164   }}
 +
{{#set: common name=L-histidinal}}
 +
{{#set: consumed by=HISTALDEHYD-RXN}}
 +
{{#set: reversible reaction associated=HISTOLDEHYD-RXN}}

Revision as of 18:09, 18 March 2018

Metabolite HISTIDINAL

  • smiles:
    • C1(NC=NC=1CC([CH]=O)[N+])
  • inchi key:
    • InChIKey=VYOIELONWKIZJS-YFKPBYRVSA-O
  • common name:
    • histidinal
  • molecular weight:
    • 140.164
  • Synonym(s):
    • L-histidinal

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C1(NC=NC=1CC([CH]=O)[N+])" cannot be used as a page name in this wiki.