Difference between revisions of "RXN-16622"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7257 CPD-7257] == * smiles: ** CC(CCC(=O)C(C)C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(O...")
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-16622 RXN-16622] == * direction: ** LEFT-TO-RIGHT * common name: ** 3-oxoacyl-(acyl-carrier-pro...")
 
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[[Category:Metabolite]]
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[[Category:Reaction]]
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7257 CPD-7257] ==
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-16622 RXN-16622] ==
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* smiles:
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* direction:
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** CC(CCC(=O)C(C)C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-])=O)[CH]4(CC[CH]5(C(C)4C(O)C[CH]6([CH]5C(O)C[CH]7(C(C)6CCC(O)C7))))
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** LEFT-TO-RIGHT
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* inchi key:
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** InChIKey=AWLXQJGPNLCTLM-YFXOTMPNSA-J
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* common name:
 
* common name:
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** 3α,7α,12α-trihydroxy-24-oxo-5-β-cholestanoyl CoA
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** 3-oxoacyl-(acyl-carrier-protein)
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* molecular weight:
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* ec number:
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** 1210.128   
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** [http://enzyme.expasy.org/EC/1.1.1.100 EC-1.1.1.100]
 
* Synonym(s):
 
* Synonym(s):
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** 3-α,7-α,12-α-trihydroxy-24-oxo-5-β-cholestanoyl CoA
 
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** 3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestanoyl-CoA
 
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** 3alpha,7alpha,12alpha-trihydroxy-5beta-24-oxocholestanoyl-CoA
 
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** 3α,7α,12α-trihydroxy-5β-cholest-24-one-CoA
 
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** 24-keto,(25R)-trihydroxycholestanoyl-CoA
 
  
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== Reaction(s) known to consume the compound ==
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== Reaction Formula ==
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* [[2.3.1.176-RXN]]
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* With identifiers:
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== Reaction(s) known to produce the compound ==
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** 1 [[NADPH]][c] '''+''' 1 [[7Z-3-oxo-hexadec-7-enoyl-ACPs]][c] '''+''' 1 [[PROTON]][c] '''=>''' 1 [[NADP]][c] '''+''' 1 [[3R-7Z-3-hydroxy-hexadec-7-enoyl-ACPs]][c]
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== Reaction(s) of unknown directionality ==
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* With common name(s):
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** 1 NADPH[c] '''+''' 1 a (7Z)-3-oxo-hexadec-7-enoyl-[acp][c] '''+''' 1 H+[c] '''=>''' 1 NADP+[c] '''+''' 1 a (3R,7Z)-3-hydroxy-hexadec-7-enoyl-[acp][c]
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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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* Gene: [[Tiso_gene_9885]]
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** Source: [[annotation-experimental_annotation]]
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*** Assignment: EC-NUMBER
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* Gene: [[Tiso_gene_13083]]
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** Source: [[annotation-in-silico_annotation]]
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*** Assignment: EC-NUMBER
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** Source: [[annotation-experimental_annotation]]
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*** Assignment: EC-NUMBER
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== Pathways  ==
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* [[PWY-7664]], oleate biosynthesis IV (anaerobic): [http://metacyc.org/META/NEW-IMAGE?object=PWY-7664 PWY-7664]
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** '''10''' reactions found over '''14''' reactions in the full pathway
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== Reconstruction information  ==
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* Category: [[annotation]]
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** Source: [[annotation-experimental_annotation]]
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*** Tool: [[pathwaytools]]
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** Source: [[annotation-in-silico_annotation]]
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*** Tool: [[pathwaytools]]
 
== External links  ==
 
== External links  ==
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* PUBCHEM:
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{{#set: direction=LEFT-TO-RIGHT}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45266665 45266665]
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{{#set: common name=3-oxoacyl-(acyl-carrier-protein)}}
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* CHEBI:
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{{#set: ec number=EC-1.1.1.100}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58507 58507]
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{{#set: gene associated=Tiso_gene_9885|Tiso_gene_13083}}
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* LIGAND-CPD:
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{{#set: in pathway=PWY-7664}}
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** [http://www.genome.jp/dbget-bin/www_bget?C05467 C05467]
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{{#set: reconstruction category=annotation}}
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* HMDB : HMDB06891
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{{#set: reconstruction source=annotation-experimental_annotation|annotation-in-silico_annotation}}
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{{#set: smiles=CC(CCC(=O)C(C)C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-])=O)[CH]4(CC[CH]5(C(C)4C(O)C[CH]6([CH]5C(O)C[CH]7(C(C)6CCC(O)C7))))}}
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: inchi key=InChIKey=AWLXQJGPNLCTLM-YFXOTMPNSA-J}}
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{{#set: common name=3α,7α,12α-trihydroxy-24-oxo-5-β-cholestanoyl CoA}}
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{{#set: molecular weight=1210.128    }}
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{{#set: common name=3-α,7-α,12-α-trihydroxy-24-oxo-5-β-cholestanoyl CoA|3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestanoyl-CoA|3alpha,7alpha,12alpha-trihydroxy-5beta-24-oxocholestanoyl-CoA|3α,7α,12α-trihydroxy-5β-cholest-24-one-CoA|24-keto,(25R)-trihydroxycholestanoyl-CoA}}
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{{#set: consumed by=2.3.1.176-RXN}}
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Latest revision as of 21:19, 21 March 2018

Reaction RXN-16622

  • direction:
    • LEFT-TO-RIGHT
  • common name:
    • 3-oxoacyl-(acyl-carrier-protein)
  • ec number:
  • Synonym(s):

Reaction Formula

Genes associated with this reaction

Genes have been associated with this reaction based on different elements listed below.

Pathways

  • PWY-7664, oleate biosynthesis IV (anaerobic): PWY-7664
    • 10 reactions found over 14 reactions in the full pathway

Reconstruction information

External links

Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=RXN-16622&oldid=47806"