Difference between revisions of "ACET"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-7644 RXN-7644] == * direction: ** REVERSIBLE * common name: ** D-sorbitol 2-dehydrogenase ** po...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACET ACET] == * smiles: ** CC([O-])=O * common name: ** acetate * inchi key: ** InChIKey=QTBSBX...")
 
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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-7644 RXN-7644] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACET ACET] ==
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* direction:
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* smiles:
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** REVERSIBLE
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** CC([O-])=O
 
* common name:
 
* common name:
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** D-sorbitol 2-dehydrogenase
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** acetate
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** polyketide_synthase
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* inchi key:
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** l-iditol_2-dehydrogenase
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** InChIKey=QTBSBXVTEAMEQO-UHFFFAOYSA-M
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* ec number:
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* molecular weight:
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** [http://enzyme.expasy.org/EC/1.1.1.14 EC-1.1.1.14]
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** 59.044   
 
* Synonym(s):
 
* Synonym(s):
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** acetic acid
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** ethanoic acid
  
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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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* [[ACETATE--COA-LIGASE-RXN]]
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** 1 [[SORBITOL]][c] '''+''' 1 [[NAD]][c] '''<=>''' 1 [[PROTON]][c] '''+''' 1 [[NADH]][c] '''+''' 1 [[CPD-15382]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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* [[UDPACYLGLCNACDEACETYL-RXN]]
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** 1 D-sorbitol[c] '''+''' 1 NAD+[c] '''<=>''' 1 H+[c] '''+''' 1 NADH[c] '''+''' 1 keto-D-fructose[c]
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* [[ACHMSSELCYSL]]
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* [[AODAA]]
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== Genes associated with this reaction  ==
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* [[ACETYLCHOLINESTERASE-RXN]]
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Genes have been associated with this reaction based on different elements listed below.
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* [[3.1.1.47-RXN]]
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* Gene: [[Tiso_gene_5424]]
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* [[ALDDH]]
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** Source: [[annotation-in-silico_annotation]]
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* [[RXN-13181]]
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*** Assignment: EC-NUMBER
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* [[ALDDHm]]
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* Gene: [[Tiso_gene_6562]]
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* [[APhi]]
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** Source: [[annotation-in-silico_annotation]]
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* [[RXN-12726]]
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*** Assignment: EC-NUMBER
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* [[SIALATE-O-ACETYLESTERASE-RXN]]
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* Gene: [[Tiso_gene_18533]]
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* [[RXN0-3962]]
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** Source: [[annotation-in-silico_annotation]]
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* [[RXN66-3]]
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*** Assignment: AUTOMATED-NAME-MATCH
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* [[RXN-13182]]
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* Gene: [[Tiso_gene_15088]]
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* [[ACHMSSELCYSLh]]
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** Source: [[orthology-esiliculosus]]
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== Reaction(s) of unknown directionality ==
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* Gene: [[Tiso_gene_6563]]
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* [[RXN-13680]]
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** Source: [[annotation-in-silico_annotation]]
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* [[3.5.1.98-RXN]]
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*** Assignment: EC-NUMBER
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* [[RXN-13684]]
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* Gene: [[Tiso_gene_5425]]
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* [[SULFOCYS-RXN]]
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** Source: [[annotation-in-silico_annotation]]
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* [[ACETYLORNDEACET-RXN]]
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*** Assignment: EC-NUMBER
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* [[ACETYLHOMOSER-CYS-RXN]]
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== Pathways  ==
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* [[RXN-14728]]
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* [[PWY-4101]], D-sorbitol degradation I: [http://metacyc.org/META/NEW-IMAGE?object=PWY-4101 PWY-4101]
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* [[ACSERLY-RXN]]
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** '''3''' reactions found over '''3''' reactions in the full pathway
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* [[ACECOATRANS-RXN-CPD-14717/ACET//R-2-HYDROXYSTEARATE/ACETYL-COA.47.]]
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== Reconstruction information  ==
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* Category: [[orthology]]
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** Source: [[orthology-esiliculosus]]
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*** Tool: [[pantograph]]
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* Category: [[annotation]]
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** Source: [[annotation-in-silico_annotation]]
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*** Tool: [[pathwaytools]]
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== External links  ==
 
== External links  ==
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* RHEA:
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* CAS : 64-19-7
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=33031 33031]
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* CAS : 71-50-1
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* LIGAND-RXN:
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* BIGG : ac
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** [http://www.genome.jp/dbget-bin/www_bget?R00875 R00875]
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* DRUGBANK : DB03166
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{{#set: direction=REVERSIBLE}}
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* PUBCHEM:
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{{#set: common name=D-sorbitol 2-dehydrogenase}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=175 175]
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{{#set: common name=polyketide_synthase}}
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* HMDB : HMDB00042
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{{#set: common name=l-iditol_2-dehydrogenase}}
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* LIGAND-CPD:
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{{#set: ec number=EC-1.1.1.14}}
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** [http://www.genome.jp/dbget-bin/www_bget?C00033 C00033]
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{{#set: gene associated=Tiso_gene_5424|Tiso_gene_6562|Tiso_gene_18533|Tiso_gene_15088|Tiso_gene_6563|Tiso_gene_5425}}
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* CHEMSPIDER:
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{{#set: in pathway=PWY-4101}}
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** [http://www.chemspider.com/Chemical-Structure.170.html 170]
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{{#set: reconstruction category=orthology|annotation}}
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* CHEBI:
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{{#set: reconstruction source=annotation-in-silico_annotation|orthology-esiliculosus}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=30089 30089]
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{{#set: reconstruction tool=pantograph|pathwaytools}}
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* METABOLIGHTS : MTBLC30089
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{{#set: smiles=CC([O-])=O}}
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{{#set: common name=acetate}}
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{{#set: inchi key=InChIKey=QTBSBXVTEAMEQO-UHFFFAOYSA-M}}
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{{#set: molecular weight=59.044    }}
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{{#set: common name=acetic acid|ethanoic acid}}
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{{#set: consumed by=ACETATE--COA-LIGASE-RXN}}
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{{#set: produced by=UDPACYLGLCNACDEACETYL-RXN|ACHMSSELCYSL|AODAA|ACETYLCHOLINESTERASE-RXN|3.1.1.47-RXN|ALDDH|RXN-13181|ALDDHm|APhi|RXN-12726|SIALATE-O-ACETYLESTERASE-RXN|RXN0-3962|RXN66-3|RXN-13182|ACHMSSELCYSLh}}
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{{#set: reversible reaction associated=RXN-13680|3.5.1.98-RXN|RXN-13684|SULFOCYS-RXN|ACETYLORNDEACET-RXN|ACETYLHOMOSER-CYS-RXN|RXN-14728|ACSERLY-RXN|ACECOATRANS-RXN-CPD-14717/ACET//R-2-HYDROXYSTEARATE/ACETYL-COA.47.}}

Latest revision as of 20:24, 21 March 2018

Metabolite ACET

  • smiles:
    • CC([O-])=O
  • common name:
    • acetate
  • inchi key:
    • InChIKey=QTBSBXVTEAMEQO-UHFFFAOYSA-M
  • molecular weight:
    • 59.044
  • Synonym(s):
    • acetic acid
    • ethanoic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 64-19-7
  • CAS : 71-50-1
  • BIGG : ac
  • DRUGBANK : DB03166
  • PUBCHEM:
  • HMDB : HMDB00042
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC30089
"CC([O-])=O" cannot be used as a page name in this wiki.




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