Difference between revisions of "CIT"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2030 CPD0-2030] == * smiles: ** C(O)C(O)COP([O-])(OCC([N+])C(=O)[O-])=O * inchi key: ** In...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CIT CIT] == * smiles: ** C(=O)([O-])CC(C(=O)[O-])(O)CC(=O)[O-] * inchi key: ** InChIKey=KRKNYBC...")
 
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2030 CPD0-2030] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CIT CIT] ==
 
* smiles:
 
* smiles:
** C(O)C(O)COP([O-])(OCC([N+])C(=O)[O-])=O
+
** C(=O)([O-])CC(C(=O)[O-])(O)CC(=O)[O-]
 
* inchi key:
 
* inchi key:
** InChIKey=ZWZWYGMENQVNFU-UHNVWZDZSA-M
+
** InChIKey=KRKNYBCHXYNGOX-UHFFFAOYSA-K
 
* common name:
 
* common name:
** glycerophosphoserine
+
** citrate
 
* molecular weight:
 
* molecular weight:
** 258.144    
+
** 189.101    
 
* Synonym(s):
 
* Synonym(s):
 +
** citr
 +
** cit
 +
** citric acid
 +
** 2-hydroxy-1,2,3-propanetricarboxylic acid
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-14136]]
+
* [[ATP-CITRATE-PRO-S--LYASE-RXN]]
 +
* [[biomass_rxn]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[CITSYN-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-14047]]
 +
* [[ACONITATEDEHYDR-RXN]]
 
== External links  ==
 
== External links  ==
 +
* CAS : 77-92-9
 +
* BIGG : 34080
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=57339260 57339260]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=31348 31348]
 +
* KNAPSACK : C00007619
 +
* HMDB : HMDB00094
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C00158 C00158]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.29081.html 29081]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=61931 61931]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16947 16947]
* BIGG : 1484554
+
* METABOLIGHTS : MTBLC16947
{{#set: smiles=C(O)C(O)COP([O-])(OCC([N+])C(=O)[O-])=O}}
+
{{#set: smiles=C(=O)([O-])CC(C(=O)[O-])(O)CC(=O)[O-]}}
{{#set: inchi key=InChIKey=ZWZWYGMENQVNFU-UHNVWZDZSA-M}}
+
{{#set: inchi key=InChIKey=KRKNYBCHXYNGOX-UHFFFAOYSA-K}}
{{#set: common name=glycerophosphoserine}}
+
{{#set: common name=citrate}}
{{#set: molecular weight=258.144   }}
+
{{#set: molecular weight=189.101   }}
{{#set: consumed by=RXN-14136}}
+
{{#set: common name=citr|cit|citric acid|2-hydroxy-1,2,3-propanetricarboxylic acid}}
 +
{{#set: consumed by=ATP-CITRATE-PRO-S--LYASE-RXN|biomass_rxn}}
 +
{{#set: produced by=CITSYN-RXN}}
 +
{{#set: reversible reaction associated=RXN-14047|ACONITATEDEHYDR-RXN}}

Latest revision as of 20:30, 21 March 2018

Metabolite CIT

  • smiles:
    • C(=O)([O-])CC(C(=O)[O-])(O)CC(=O)[O-]
  • inchi key:
    • InChIKey=KRKNYBCHXYNGOX-UHFFFAOYSA-K
  • common name:
    • citrate
  • molecular weight:
    • 189.101
  • Synonym(s):
    • citr
    • cit
    • citric acid
    • 2-hydroxy-1,2,3-propanetricarboxylic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 77-92-9
  • BIGG : 34080
  • PUBCHEM:
  • KNAPSACK : C00007619
  • HMDB : HMDB00094
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC16947
"C(=O)([O-])CC(C(=O)[O-])(O)CC(=O)[O-" cannot be used as a page name in this wiki.