Difference between revisions of "CPD-16458"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=N-ACETYL-NEURAMINATE-9P N-ACETYL-NEURAMINATE-9P] == * smiles: ** CC(=O)NC1(C(CC(C([O-])=O)(O)O[...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-16458 CPD-16458] == * smiles: ** C2(=O)(C1(=C(NCC=N1)NC(=O)N2)) * common name: ** 7,8-dihyd...")
 
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=N-ACETYL-NEURAMINATE-9P N-ACETYL-NEURAMINATE-9P] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-16458 CPD-16458] ==
 
* smiles:
 
* smiles:
−
** CC(=O)NC1(C(CC(C([O-])=O)(O)O[CH]1C(O)C(O)COP([O-])([O-])=O)O)
+
** C2(=O)(C1(=C(NCC=N1)NC(=O)N2))
 
* common name:
 
* common name:
−
** N-acetyl-β-neuraminate 9-phosphate
+
** 7,8-dihydrolumazine
 
* inchi key:
 
* inchi key:
−
** InChIKey=SQMNIXJSBCSNCI-PFQGKNLYSA-K
+
** InChIKey=MYJNEEHZESREMO-UHFFFAOYSA-N
 
* molecular weight:
 
* molecular weight:
−
** 386.229    
+
** 166.139    
 
* Synonym(s):
 
* Synonym(s):
−
** N-acetyl-β-neuraminate-9-P
 
−
** N-acetyl-β-neuraminic acid 9-phosphate
 
  
 
== 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 ==
−
* [[RXN-9988]]
+
* [[RXN-15261]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* LIGAND-CPD:
 
−
** [http://www.genome.jp/dbget-bin/www_bget?C06241 C06241]
 
−
* HMDB : HMDB04381
 
−
* CHEBI:
 
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=27438 27438]
 
−
* METABOLIGHTS : MTBLC27438
 
 
* PUBCHEM:
 
* PUBCHEM:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90658964 90658964]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=590555 590555]
−
{{#set: smiles=CC(=O)NC1(C(CC(C([O-])=O)(O)O[CH]1C(O)C(O)COP([O-])([O-])=O)O)}}
+
{{#set: smiles=C2(=O)(C1(=C(NCC=N1)NC(=O)N2))}}
−
{{#set: common name=N-acetyl-β-neuraminate 9-phosphate}}
+
{{#set: common name=7,8-dihydrolumazine}}
−
{{#set: inchi key=InChIKey=SQMNIXJSBCSNCI-PFQGKNLYSA-K}}
+
{{#set: inchi key=InChIKey=MYJNEEHZESREMO-UHFFFAOYSA-N}}
−
{{#set: molecular weight=386.229   }}
+
{{#set: molecular weight=166.139   }}
−
{{#set: common name=N-acetyl-β-neuraminate-9-P|N-acetyl-β-neuraminic acid 9-phosphate}}
+
{{#set: produced by=RXN-15261}}
−
{{#set: produced by=RXN-9988}}
+

Latest revision as of 20:48, 21 March 2018

Metabolite CPD-16458

  • smiles:
    • C2(=O)(C1(=C(NCC=N1)NC(=O)N2))
  • common name:
    • 7,8-dihydrolumazine
  • inchi key:
    • InChIKey=MYJNEEHZESREMO-UHFFFAOYSA-N
  • molecular weight:
    • 166.139
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links



Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=CPD-16458&oldid=43899"