Difference between revisions of "GLUCONATE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=GLUCONATE GLUCONATE] == * smiles: ** C(O)C(O)C(O)C(O)C(O)C(=O)[O-] * inchi key: ** InChIKey=RGH...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13575 CPD-13575] == * smiles: ** CC1(C(=CCOP([O-])(=O)[O-])SC(C(=O)[O-])N=1) * inchi key: *...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=GLUCONATE GLUCONATE] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13575 CPD-13575] ==
 
* smiles:
 
* smiles:
** C(O)C(O)C(O)C(O)C(O)C(=O)[O-]
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** CC1(C(=CCOP([O-])(=O)[O-])SC(C(=O)[O-])N=1)
 
* inchi key:
 
* inchi key:
** InChIKey=RGHNJXZEOKUKBD-SQOUGZDYSA-M
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** InChIKey=PQMCQNOVNFNPFJ-HYIMLASBSA-K
 
* common name:
 
* common name:
** D-gluconate
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** 2-[(2R,5Z)-2-carboxy-4-methylthiazol-5(2H)-ylidene]ethyl phosphate
 
* molecular weight:
 
* molecular weight:
** 195.149    
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** 264.169    
 
* Synonym(s):
 
* Synonym(s):
** D-gluconic acid
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** cThz*-P
** dextronic acid
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** thiazole tautomer
** maltonic acid
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** (R,Z)-2-(2-carboxy-4-methylthiazol-5(2H)-ylidene)ethyl phosphate
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-12611]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[GLUCONOLACT-RXN]]
 
* [[RXN-17754]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
* CAS : 526-95-4
 
* METABOLIGHTS : MTBLC18391
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6419706 6419706]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=53477654 53477654]
* HMDB : HMDB00625
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* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C00257 C00257]
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* CHEMSPIDER:
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** [http://www.chemspider.com/Chemical-Structure.4925340.html 4925340]
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* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18391 18391]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62899 62899]
* BIGG : glcn
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{{#set: smiles=CC1(C(=CCOP([O-])(=O)[O-])SC(C(=O)[O-])N=1)}}
{{#set: smiles=C(O)C(O)C(O)C(O)C(O)C(=O)[O-]}}
+
{{#set: inchi key=InChIKey=PQMCQNOVNFNPFJ-HYIMLASBSA-K}}
{{#set: inchi key=InChIKey=RGHNJXZEOKUKBD-SQOUGZDYSA-M}}
+
{{#set: common name=2-[(2R,5Z)-2-carboxy-4-methylthiazol-5(2H)-ylidene]ethyl phosphate}}
{{#set: common name=D-gluconate}}
+
{{#set: molecular weight=264.169   }}
{{#set: molecular weight=195.149   }}
+
{{#set: common name=cThz*-P|thiazole tautomer|(R,Z)-2-(2-carboxy-4-methylthiazol-5(2H)-ylidene)ethyl phosphate}}
{{#set: common name=D-gluconic acid|dextronic acid|maltonic acid}}
+
{{#set: consumed by=RXN-12611}}
{{#set: produced by=GLUCONOLACT-RXN|RXN-17754}}
+

Revision as of 17:12, 10 January 2018

Metabolite CPD-13575

  • smiles:
    • CC1(C(=CCOP([O-])(=O)[O-])SC(C(=O)[O-])N=1)
  • inchi key:
    • InChIKey=PQMCQNOVNFNPFJ-HYIMLASBSA-K
  • common name:
    • 2-[(2R,5Z)-2-carboxy-4-methylthiazol-5(2H)-ylidene]ethyl phosphate
  • molecular weight:
    • 264.169
  • Synonym(s):
    • cThz*-P
    • thiazole tautomer
    • (R,Z)-2-(2-carboxy-4-methylthiazol-5(2H)-ylidene)ethyl phosphate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC1(C(=CCOP([O-])(=O)[O-])SC(C(=O)[O-])N=1)" cannot be used as a page name in this wiki.
"2-[(2R,5Z)-2-carboxy-4-methylthiazol-5(2H)-ylidene]ethyl phosphate" cannot be used as a page name in this wiki.