Difference between revisions of "CPD-804"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17372 CPD-17372] == * smiles: ** C(O)CCCCCCCC=CCCCCCCCC(=O)OCC(COP([O-])([O-])=O)O * inchi...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-804 CPD-804] == * smiles: ** C(CCC(O)CC(C([O-])=O)=O)([O-])=O * common name: ** (4S)-4-hydr...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17372 CPD-17372] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-804 CPD-804] ==
 
* smiles:
 
* smiles:
** C(O)CCCCCCCC=CCCCCCCCC(=O)OCC(COP([O-])([O-])=O)O
+
** C(CCC(O)CC(C([O-])=O)=O)([O-])=O
* inchi key:
+
** InChIKey=GFJKJLHWWZXDAU-KXFGNQBASA-L
+
 
* common name:
 
* common name:
** 1-[18-hydroxyoleyl]-2-lyso-phosphatidate
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** (4S)-4-hydroxy-2-oxoheptanedioate
 +
* inchi key:
 +
** InChIKey=HNOAJOYERZTSNK-BYPYZUCNSA-L
 
* molecular weight:
 
* molecular weight:
** 450.508    
+
** 188.137    
 
* Synonym(s):
 
* Synonym(s):
 +
** 4-hydroxy-2-ketoheptane-1,7-dioate
 +
** 2-oxo-4-hydroxyhepta-1,7-dioate
 +
** 4-hydroxy-2-oxo-heptanedioate
 +
** 4-hydroxy-2-ketopimelate
 +
** 2-keto-4-hydroxypimelate
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-16118]]
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* [[4-HYDROXY-2-KETOPIMELATE-LYSIS-RXN]]
 
== 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:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91820233 91820233]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91828275 91828275]
{{#set: smiles=C(O)CCCCCCCC=CCCCCCCCC(=O)OCC(COP([O-])([O-])=O)O}}
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* CHEMSPIDER:
{{#set: inchi key=InChIKey=GFJKJLHWWZXDAU-KXFGNQBASA-L}}
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** [http://www.chemspider.com/Chemical-Structure.19951289.html 19951289]
{{#set: common name=1-[18-hydroxyoleyl]-2-lyso-phosphatidate}}
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* CHEBI:
{{#set: molecular weight=450.508   }}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=87522 87522]
{{#set: consumed by=RXN-16118}}
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* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C05601 C05601]
 +
{{#set: smiles=C(CCC(O)CC(C([O-])=O)=O)([O-])=O}}
 +
{{#set: common name=(4S)-4-hydroxy-2-oxoheptanedioate}}
 +
{{#set: inchi key=InChIKey=HNOAJOYERZTSNK-BYPYZUCNSA-L}}
 +
{{#set: molecular weight=188.137   }}
 +
{{#set: common name=4-hydroxy-2-ketoheptane-1,7-dioate|2-oxo-4-hydroxyhepta-1,7-dioate|4-hydroxy-2-oxo-heptanedioate|4-hydroxy-2-ketopimelate|2-keto-4-hydroxypimelate}}
 +
{{#set: consumed by=4-HYDROXY-2-KETOPIMELATE-LYSIS-RXN}}

Latest revision as of 21:00, 21 March 2018

Metabolite CPD-804

  • smiles:
    • C(CCC(O)CC(C([O-])=O)=O)([O-])=O
  • common name:
    • (4S)-4-hydroxy-2-oxoheptanedioate
  • inchi key:
    • InChIKey=HNOAJOYERZTSNK-BYPYZUCNSA-L
  • molecular weight:
    • 188.137
  • Synonym(s):
    • 4-hydroxy-2-ketoheptane-1,7-dioate
    • 2-oxo-4-hydroxyhepta-1,7-dioate
    • 4-hydroxy-2-oxo-heptanedioate
    • 4-hydroxy-2-ketopimelate
    • 2-keto-4-hydroxypimelate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C(CCC(O)CC(C([O-])=O)=O)([O-])=O" cannot be used as a page name in this wiki.