Difference between revisions of "ACETONE"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-9531 RXN-9531] == * direction: ** LEFT-TO-RIGHT * common name: ** 3-oxo-dodecanoyl-[acyl-carrie...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACETONE ACETONE] == * smiles: ** CC(=O)C * inchi key: ** InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N *...")
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-9531 RXN-9531] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACETONE ACETONE] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CC(=O)C
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* inchi key:
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** InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N
 
* common name:
 
* common name:
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** 3-oxo-dodecanoyl-[acyl-carrier protein] synthase
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** acetone
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** Beta-ketoacyl synthase
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* molecular weight:
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* ec number:
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** 58.08   
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** [http://enzyme.expasy.org/EC/2.3.1.41 EC-2.3.1.41]
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* Synonym(s):
 
* Synonym(s):
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** dimethylketone
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** 2-propanone
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** propanone
  
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== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
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* With identifiers:
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* [[RXN-8630]]
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** 1 [[PROTON]][c] '''+''' 1 [[MALONYL-ACP]][c] '''+''' 1 [[Decanoyl-ACPs]][c] '''=>''' 1 [[ACP]][c] '''+''' 1 [[3-oxo-dodecanoyl-ACPs]][c] '''+''' 1 [[CARBON-DIOXIDE]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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* [[ACETOACETATE-DECARBOXYLASE-RXN]]
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** 1 H+[c] '''+''' 1 a malonyl-[acp][c] '''+''' 1 a decanoyl-[acp][c] '''=>''' 1 a holo-[acyl-carrier protein][c] '''+''' 1 a 3-oxo-dodecanoyl-[acp][c] '''+''' 1 CO2[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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* [[CHC_T00009465001_1]]
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** [[pantograph]]-[[a.taliana]]
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** [[pantograph]]-[[a.taliana]]
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* [[CHC_T00009465001]]
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** ORIGINAL_GENOME
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***AUTOMATED-NAME-MATCH
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== Pathways  ==
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* [[PWY-5971]], palmitate biosynthesis II (bacteria and plants): [http://metacyc.org/META/NEW-IMAGE?object=PWY-5971 PWY-5971]
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** '''31''' reactions found over '''31''' 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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*** [[a.taliana]]
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* [[annotation]]:
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** [[pathwaytools]]:
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*** [[original_genome]]
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== External links  ==
 
== External links  ==
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{{#set: direction=LEFT-TO-RIGHT}}
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* CAS : 67-64-1
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{{#set: common name=3-oxo-dodecanoyl-[acyl-carrier protein] synthase}}
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* PUBCHEM:
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{{#set: common name=Beta-ketoacyl synthase}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=180 180]
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{{#set: ec number=EC-2.3.1.41}}
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* HMDB : HMDB01659
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{{#set: gene associated=CHC_T00009465001_1|CHC_T00009465001}}
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* LIGAND-CPD:
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{{#set: in pathway=PWY-5971}}
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** [http://www.genome.jp/dbget-bin/www_bget?C00207 C00207]
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{{#set: reconstruction category=orthology}}
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* CHEMSPIDER:
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{{#set: reconstruction tool=pantograph}}
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** [http://www.chemspider.com/Chemical-Structure.175.html 175]
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{{#set: reconstruction source=a.taliana}}
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* CHEBI:
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{{#set: reconstruction category=annotation}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15347 15347]
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{{#set: reconstruction tool=pathwaytools}}
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* METABOLIGHTS : MTBLC15347
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{{#set: reconstruction source=original_genome}}
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{{#set: smiles=CC(=O)C}}
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{{#set: inchi key=InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N}}
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{{#set: common name=acetone}}
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{{#set: molecular weight=58.08    }}
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{{#set: common name=dimethylketone|2-propanone|propanone}}
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{{#set: consumed by=RXN-8630}}
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{{#set: produced by=ACETOACETATE-DECARBOXYLASE-RXN}}

Revision as of 15:34, 23 May 2018

Metabolite ACETONE

  • smiles:
    • CC(=O)C
  • inchi key:
    • InChIKey=CSCPPACGZOOCGX-UHFFFAOYSA-N
  • common name:
    • acetone
  • molecular weight:
    • 58.08
  • Synonym(s):
    • dimethylketone
    • 2-propanone
    • propanone

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 67-64-1
  • PUBCHEM:
  • HMDB : HMDB01659
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC15347




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