Difference between revisions of "CPD-1242"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PANTETHEINE-P PANTETHEINE-P] == * smiles: ** CC(C(O)C(=O)NCCC(NCCS)=O)(C)COP([O-])(=O)[O-] * co...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-1242 CPD-1242] == * smiles: ** C(O)C1(OC(C(C(C1O)=O)O)O) * common name: ** 3-keto-β-D-...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PANTETHEINE-P PANTETHEINE-P] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-1242 CPD-1242] ==
 
* smiles:
 
* smiles:
−
** CC(C(O)C(=O)NCCC(NCCS)=O)(C)COP([O-])(=O)[O-]
+
** C(O)C1(OC(C(C(C1O)=O)O)O)
 
* common name:
 
* common name:
−
** 4'-phosphopantetheine
+
** 3-keto-β-D-galactose
 
* inchi key:
 
* inchi key:
−
** InChIKey=JDMUPRLRUUMCTL-VIFPVBQESA-L
+
** InChIKey=APIQNBNBIICCON-FKMSRSAHSA-N
 
* molecular weight:
 
* molecular weight:
−
** 356.33    
+
** 178.141    
 
* Synonym(s):
 
* Synonym(s):
−
** phosphopantotheine
+
** 3-dehydro-β-D-galactose
−
** pantetheine 4'-phosphate
+
−
** phosphopantetheine
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[PANTEPADENYLYLTRAN-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[P-PANTOCYSDECARB-RXN]]
+
* [[KETOLACTOSE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[PANTETHEINE-KINASE-RXN]]
 
 
== External links  ==
 
== External links  ==
−
* BIGG : pan4p
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245905 25245905]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=440653 440653]
−
* HMDB : HMDB01416
+
* HMDB : HMDB01385
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C01134 C01134]
+
** [http://www.genome.jp/dbget-bin/www_bget?C05394 C05394]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.389534.html 389534]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=61723 61723]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=27453 27453]
−
* METABOLIGHTS : MTBLC61723
+
* METABOLIGHTS : MTBLC27453
−
{{#set: smiles=CC(C(O)C(=O)NCCC(NCCS)=O)(C)COP([O-])(=O)[O-]}}
+
{{#set: smiles=C(O)C1(OC(C(C(C1O)=O)O)O)}}
−
{{#set: common name=4'-phosphopantetheine}}
+
{{#set: common name=3-keto-β-D-galactose}}
−
{{#set: inchi key=InChIKey=JDMUPRLRUUMCTL-VIFPVBQESA-L}}
+
{{#set: inchi key=InChIKey=APIQNBNBIICCON-FKMSRSAHSA-N}}
−
{{#set: molecular weight=356.33   }}
+
{{#set: molecular weight=178.141   }}
−
{{#set: common name=phosphopantotheine|pantetheine 4'-phosphate|phosphopantetheine}}
+
{{#set: common name=3-dehydro-β-D-galactose}}
−
{{#set: consumed by=PANTEPADENYLYLTRAN-RXN}}
+
{{#set: produced by=KETOLACTOSE-RXN}}
−
{{#set: produced by=P-PANTOCYSDECARB-RXN}}
+
−
{{#set: reversible reaction associated=PANTETHEINE-KINASE-RXN}}
+

Latest revision as of 20:04, 21 March 2018

Metabolite CPD-1242

  • smiles:
    • C(O)C1(OC(C(C(C1O)=O)O)O)
  • common name:
    • 3-keto-β-D-galactose
  • inchi key:
    • InChIKey=APIQNBNBIICCON-FKMSRSAHSA-N
  • molecular weight:
    • 178.141
  • Synonym(s):
    • 3-dehydro-β-D-galactose

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-1242&oldid=39333"