Difference between revisions of "3.1.26.4-RXN"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PREPHENATE PREPHENATE] == * smiles: ** C(=O)([O-])C(=O)CC1(C(=O)[O-])(C=CC(O)C=C1) * inchi key:...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=NONAPRENYL-4-HYDROXYBENZOATE NONAPRENYL-4-HYDROXYBENZOATE] == * smiles: ** CC(=CCCC(=CCCC(=CCCC...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PREPHENATE PREPHENATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=NONAPRENYL-4-HYDROXYBENZOATE NONAPRENYL-4-HYDROXYBENZOATE] ==
 
* smiles:
 
* smiles:
−
** C(=O)([O-])C(=O)CC1(C(=O)[O-])(C=CC(O)C=C1)
+
** CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCC1(=C(O)C=CC(C(=O)[O-])=C1))C)C)C)C)C)C)C)C)C
 
* inchi key:
 
* inchi key:
−
** InChIKey=FPWMCUPFBRFMLH-XGAOUMNUSA-L
+
** InChIKey=YKKKMRBEPIZPBH-XWEAJCOCSA-M
 
* common name:
 
* common name:
−
** prephenate
+
** 3-nonaprenyl-4-hydroxybenzoate
 
* molecular weight:
 
* molecular weight:
−
** 224.17    
+
** 750.178    
 
* Synonym(s):
 
* Synonym(s):
 +
** 3-solanesyl-4-hydroxybenzoate
 +
** nonaprenyl-4-hydroxybenzoic acid
 +
** 3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl ester
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[PREPHENATEDEHYDROG-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[2.5.1.39-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[PREPHENATE-TRANSAMINE-RXN]]
 
−
* [[PREPHENATEDEHYDRAT-RXN]]
 
−
* [[PREPHENATE-DEHYDROGENASE-NADP+-RXN]]
 
−
* [[PREPHENATE-ASP-TRANSAMINE-RXN]]
 
−
* [[CHORISMATEMUT-RXN]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 126-49-8
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460303 5460303]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54746221 54746221]
−
* HMDB : HMDB12283
+
−
* LIGAND-CPD:
+
−
** [http://www.genome.jp/dbget-bin/www_bget?C00254 C00254]
+
−
* CHEMSPIDER:
+
−
** [http://www.chemspider.com/Chemical-Structure.4573884.html 4573884]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29934 29934]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=84502 84502]
−
* BIGG : 34406
+
* LIGAND-CPD:
−
{{#set: smiles=C(=O)([O-])C(=O)CC1(C(=O)[O-])(C=CC(O)C=C1)}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C03885 C03885]
−
{{#set: inchi key=InChIKey=FPWMCUPFBRFMLH-XGAOUMNUSA-L}}
+
* HMDB : HMDB32488
−
{{#set: common name=prephenate}}
+
{{#set: smiles=CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCC1(=C(O)C=CC(C(=O)[O-])=C1))C)C)C)C)C)C)C)C)C}}
−
{{#set: molecular weight=224.17   }}
+
{{#set: inchi key=InChIKey=YKKKMRBEPIZPBH-XWEAJCOCSA-M}}
−
{{#set: consumed by=PREPHENATEDEHYDROG-RXN}}
+
{{#set: common name=3-nonaprenyl-4-hydroxybenzoate}}
−
{{#set: consumed or produced by=PREPHENATE-TRANSAMINE-RXN|PREPHENATEDEHYDRAT-RXN|PREPHENATE-DEHYDROGENASE-NADP+-RXN|PREPHENATE-ASP-TRANSAMINE-RXN|CHORISMATEMUT-RXN}}
+
{{#set: molecular weight=750.178   }}
 +
{{#set: common name=3-solanesyl-4-hydroxybenzoate|nonaprenyl-4-hydroxybenzoic acid|3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl ester}}
 +
{{#set: produced by=2.5.1.39-RXN}}

Revision as of 20:33, 17 March 2018

Metabolite NONAPRENYL-4-HYDROXYBENZOATE

  • smiles:
    • CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCC1(=C(O)C=CC(C(=O)[O-])=C1))C)C)C)C)C)C)C)C)C
  • inchi key:
    • InChIKey=YKKKMRBEPIZPBH-XWEAJCOCSA-M
  • common name:
    • 3-nonaprenyl-4-hydroxybenzoate
  • molecular weight:
    • 750.178
  • Synonym(s):
    • 3-solanesyl-4-hydroxybenzoate
    • nonaprenyl-4-hydroxybenzoic acid
    • 3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaenyl ester

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCC1(=C(O)C=CC(C(=O)[O-])=C1))C)C)C)C)C)C)C)C)C" cannot be used as a page name in this wiki.



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