Difference between revisions of "PWY-5744"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-12693 RXN-12693] == * direction: ** LEFT-TO-RIGHT * ec number: ** [http://enzyme.expasy.org/EC/...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SHIKIMATE SHIKIMATE] == * smiles: ** C1(=C(CC(C(O)C(O)1)O)C(=O)[O-]) * inchi key: ** InChIKey=J...")
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[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-12693 RXN-12693] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SHIKIMATE SHIKIMATE] ==
* direction:
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* smiles:
** LEFT-TO-RIGHT
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** C1(=C(CC(C(O)C(O)1)O)C(=O)[O-])
* ec number:
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* inchi key:
** [http://enzyme.expasy.org/EC/1.1.1.145 EC-1.1.1.145]
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** InChIKey=JXOHGGNKMLTUBP-HSUXUTPPSA-M
 +
* common name:
 +
** shikimate
 +
* molecular weight:
 +
** 173.145  
 
* Synonym(s):
 
* Synonym(s):
 +
** shikimic acid
 +
** (3R,4S,5R)--3,4,5-trihydroxycyclohex-1-ene-1-carboxylate
  
== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
* With identifiers:
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* [[RXN-7968]]
** 1 [[CHOLESTEROL]][c] '''+''' 1 [[NAD]][c] '''=>''' 1 [[PROTON]][c] '''+''' 1 [[CPD-13684]][c] '''+''' 1 [[NADH]][c]
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== Reaction(s) known to produce the compound ==
* With common name(s):
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* [[SHIKIMATE-5-DEHYDROGENASE-RXN]]
** 1 cholesterol[c] '''+''' 1 NAD+[c] '''=>''' 1 H+[c] '''+''' 1 cholest-5-en-3-one[c] '''+''' 1 NADH[c]
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== Reaction(s) of unknown directionality ==
 
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* [[SHIKIMATE-KINASE-RXN]]
== Genes associated with this reaction  ==
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Genes have been associated with this reaction based on different elements listed below.
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* [[CHC_T00007359001_1]]
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** [[pantograph]]-[[galdieria.sulphuraria]]
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== Pathways  ==
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* [[PWY-6946]], cholesterol degradation to androstenedione II (cholesterol dehydrogenase): [http://metacyc.org/META/NEW-IMAGE?object=PWY-6946 PWY-6946]
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** '''3''' reactions found over '''22''' reactions in the full pathway
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== Reconstruction information  ==
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* [[orthology]]:
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** [[pantograph]]:
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*** [[galdieria.sulphuraria]]
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== External links  ==
 
== External links  ==
{{#set: direction=LEFT-TO-RIGHT}}
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* CAS : 138-59-0
{{#set: ec number=EC-1.1.1.145}}
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* PUBCHEM:
{{#set: gene associated=CHC_T00007359001_1}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=7057976 7057976]
{{#set: in pathway=PWY-6946}}
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* HMDB : HMDB03070
{{#set: reconstruction category=orthology}}
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* LIGAND-CPD:
{{#set: reconstruction tool=pantograph}}
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** [http://www.genome.jp/dbget-bin/www_bget?C00493 C00493]
{{#set: reconstruction source=galdieria.sulphuraria}}
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* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.5414360.html 5414360]
 +
* CHEBI:
 +
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=36208 36208]
 +
* BIGG : skm
 +
{{#set: smiles=C1(=C(CC(C(O)C(O)1)O)C(=O)[O-])}}
 +
{{#set: inchi key=InChIKey=JXOHGGNKMLTUBP-HSUXUTPPSA-M}}
 +
{{#set: common name=shikimate}}
 +
{{#set: molecular weight=173.145    }}
 +
{{#set: common name=shikimic acid|(3R,4S,5R)--3,4,5-trihydroxycyclohex-1-ene-1-carboxylate}}
 +
{{#set: consumed by=RXN-7968}}
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{{#set: produced by=SHIKIMATE-5-DEHYDROGENASE-RXN}}
 +
{{#set: consumed or produced by=SHIKIMATE-KINASE-RXN}}

Revision as of 11:22, 18 January 2018

Metabolite SHIKIMATE

  • smiles:
    • C1(=C(CC(C(O)C(O)1)O)C(=O)[O-])
  • inchi key:
    • InChIKey=JXOHGGNKMLTUBP-HSUXUTPPSA-M
  • common name:
    • shikimate
  • molecular weight:
    • 173.145
  • Synonym(s):
    • shikimic acid
    • (3R,4S,5R)--3,4,5-trihydroxycyclohex-1-ene-1-carboxylate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C1(=C(CC(C(O)C(O)1)O)C(=O)[O-])" cannot be used as a page name in this wiki.