Difference between revisions of "CPD-10261"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=6.3.4.11-RXN 6.3.4.11-RXN] == * direction: ** LEFT-TO-RIGHT * ec number: ** [http://enzyme.expasy.o...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10261 CPD-10261] == * smiles: ** CCCCCCCCCCCCCCCC(O)CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-]...")
 
Line 1: Line 1:
[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=6.3.4.11-RXN 6.3.4.11-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10261 CPD-10261] ==
* direction:
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* smiles:
** LEFT-TO-RIGHT
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** CCCCCCCCCCCCCCCC(O)CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O
* ec number:
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* common name:
** [http://enzyme.expasy.org/EC/6.3.4.11 EC-6.3.4.11]
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** (3R)-3-hydroxy-stearoyl-CoA
 +
* inchi key:
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** InChIKey=WZMAIEGYXCOYSH-MKPUJKMASA-J
 +
* molecular weight:
 +
** 1045.968   
 
* Synonym(s):
 
* Synonym(s):
 +
** (3R)-3-hydroxyoctadecanoyl-CoA
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** β-hydroxystearoyl-CoA
  
== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
* With identifiers:
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== Reaction(s) known to produce the compound ==
** 1 [[BIOTIN]][c] '''+''' 1 [[ATP]][c] '''+''' 1 [[Apo-3-methylcrotonoyl-CoA-carbon-dioxide]][c] '''=>''' 1 [[PPI]][c] '''+''' 1 [[AMP]][c] '''+''' 1 [[3-methylcrotonoyl-CoA-carbon-dioxide]][c]
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* [[RXN-9544]]
* With common name(s):
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== Reaction(s) of unknown directionality ==
** 1 biotin[c] '''+''' 1 ATP[c] '''+''' 1 an apo-[3-methylcrotonoyl-CoA:carbon-dioxide ligase (ADP-forming)][c] '''=>''' 1 diphosphate[c] '''+''' 1 AMP[c] '''+''' 1 a holo-[3-methylcrotonoyl-CoA:carbon-dioxide ligase (ADP-forming)][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_17216]]
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** Source: [[orthology-esiliculosus]]
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* Gene: [[Tiso_gene_8713]]
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** Source: [[orthology-esiliculosus]]
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== Pathways  ==
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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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== External links  ==
 
== External links  ==
* LIGAND-RXN:
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* PUBCHEM:
** [http://www.genome.jp/dbget-bin/www_bget?R04604 R04604]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=46173131 46173131]
{{#set: direction=LEFT-TO-RIGHT}}
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* HMDB : HMDB12715
{{#set: ec number=EC-6.3.4.11}}
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* CHEBI:
{{#set: gene associated=Tiso_gene_17216|Tiso_gene_8713}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=76374 76374]
{{#set: in pathway=}}
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* LIGAND-CPD:
{{#set: reconstruction category=orthology}}
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** [http://www.genome.jp/dbget-bin/www_bget?C16217 C16217]
{{#set: reconstruction source=orthology-esiliculosus}}
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{{#set: smiles=CCCCCCCCCCCCCCCC(O)CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O}}
{{#set: reconstruction tool=pantograph}}
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{{#set: common name=(3R)-3-hydroxy-stearoyl-CoA}}
 +
{{#set: inchi key=InChIKey=WZMAIEGYXCOYSH-MKPUJKMASA-J}}
 +
{{#set: molecular weight=1045.968    }}
 +
{{#set: common name=(3R)-3-hydroxyoctadecanoyl-CoA|β-hydroxystearoyl-CoA}}
 +
{{#set: produced by=RXN-9544}}

Latest revision as of 20:46, 21 March 2018

Metabolite CPD-10261

  • smiles:
    • CCCCCCCCCCCCCCCC(O)CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O
  • common name:
    • (3R)-3-hydroxy-stearoyl-CoA
  • inchi key:
    • InChIKey=WZMAIEGYXCOYSH-MKPUJKMASA-J
  • molecular weight:
    • 1045.968
  • Synonym(s):
    • (3R)-3-hydroxyoctadecanoyl-CoA
    • β-hydroxystearoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCCCCCCCCCCC(O)CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O" cannot be used as a page name in this wiki.