Difference between revisions of "CPD-10600"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-7648 RXN-7648] == * direction: ** LEFT-TO-RIGHT * ec number: ** [http://enzyme.expasy.org/EC/1....")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10600 CPD-10600] == * smiles: ** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)C1(C=CC(O)=CC=1))COP...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-7648 RXN-7648] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10600 CPD-10600] ==
* direction:
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* smiles:
** LEFT-TO-RIGHT
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** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)C1(C=CC(O)=CC=1))COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]
* ec number:
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* common name:
** [http://enzyme.expasy.org/EC/1.14.11.9 EC-1.14.11.9]
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** 4-hydroxybenzoyl-acetyl-CoA
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* inchi key:
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** InChIKey=OVQOJJJXNYHOPR-FUEUKBNZSA-J
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* molecular weight:
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** 925.647   
 
* Synonym(s):
 
* Synonym(s):
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** 3-(4-hydroxyphenyl)-3-oxo-propanoyl-CoA
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** 3-(4-hydroxyphenyl)-3-keto-propanoyl-CoA
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** 3-(4-hydroxyphenyl)-3-keto-propionyl-CoA
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** 3-(4-hydroxyphenyl)-3-oxo-propionyl-CoA
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** p-hydroxybenzoyl-acetyl-CoA
  
== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
* With identifiers:
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* [[RXN-11246]]
** 1 [[CPD-6991]][c] '''+''' 1 [[2-KETOGLUTARATE]][c] '''+''' 1 [[OXYGEN-MOLECULE]][c] '''=>''' 1 [[CPD-6992]][c] '''+''' 1 [[CARBON-DIOXIDE]][c] '''+''' 1 [[SUC]][c]
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== Reaction(s) known to produce the compound ==
* With common name(s):
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* [[RXN-11245]]
** 1 (2S)-pinocembrin[c] '''+''' 1 2-oxoglutarate[c] '''+''' 1 oxygen[c] '''=>''' 1 (+)-pinobanksin[c] '''+''' 1 CO2[c] '''+''' 1 succinate[c]
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== Reaction(s) of unknown directionality ==
 
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== 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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* [[Tiso_gene_3330]]
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** [[pantograph]]-[[athaliana]]
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** [[pantograph]]-[[esiliculosus]]
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== Pathways  ==
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* [[PWY-5059]], pinobanksin biosynthesis: [http://metacyc.org/META/NEW-IMAGE?object=PWY-5059 PWY-5059]
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** '''2''' reactions found over '''4''' reactions in the full pathway
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== Reconstruction information  ==
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* Category: [[orthology]]
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** Source: [[orthology-athaliana]]
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*** Tool: [[pantograph]]
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** Source: [[orthology-esiliculosus]]
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*** Tool: [[pantograph]]
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== External links  ==
 
== External links  ==
* LIGAND-RXN:
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* PUBCHEM:
** [http://www.genome.jp/dbget-bin/www_bget?R07993 R07993]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25200630 25200630]
{{#set: direction=LEFT-TO-RIGHT}}
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{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)C1(C=CC(O)=CC=1))COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]}}
{{#set: ec number=EC-1.14.11.9}}
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{{#set: common name=4-hydroxybenzoyl-acetyl-CoA}}
{{#set: gene associated=Tiso_gene_3330}}
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{{#set: inchi key=InChIKey=OVQOJJJXNYHOPR-FUEUKBNZSA-J}}
{{#set: in pathway=PWY-5059}}
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{{#set: molecular weight=925.647    }}
{{#set: reconstruction category=orthology}}
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{{#set: common name=3-(4-hydroxyphenyl)-3-oxo-propanoyl-CoA|3-(4-hydroxyphenyl)-3-keto-propanoyl-CoA|3-(4-hydroxyphenyl)-3-keto-propionyl-CoA|3-(4-hydroxyphenyl)-3-oxo-propionyl-CoA|p-hydroxybenzoyl-acetyl-CoA}}
{{#set: reconstruction source=orthology-athaliana|orthology-esiliculosus}}
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{{#set: consumed by=RXN-11246}}
{{#set: reconstruction tool=pantograph}}
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{{#set: produced by=RXN-11245}}

Latest revision as of 19:26, 21 March 2018

Metabolite CPD-10600

  • smiles:
    • CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)C1(C=CC(O)=CC=1))COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]
  • common name:
    • 4-hydroxybenzoyl-acetyl-CoA
  • inchi key:
    • InChIKey=OVQOJJJXNYHOPR-FUEUKBNZSA-J
  • molecular weight:
    • 925.647
  • Synonym(s):
    • 3-(4-hydroxyphenyl)-3-oxo-propanoyl-CoA
    • 3-(4-hydroxyphenyl)-3-keto-propanoyl-CoA
    • 3-(4-hydroxyphenyl)-3-keto-propionyl-CoA
    • 3-(4-hydroxyphenyl)-3-oxo-propionyl-CoA
    • p-hydroxybenzoyl-acetyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)C1(C=CC(O)=CC=1))COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-" cannot be used as a page name in this wiki.