Difference between revisions of "CPD-17324"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=CHD-RXN CHD-RXN] == * direction: ** REVERSIBLE * common name: ** glucose-methanol-choline_oxidoredu...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17324 CPD-17324] == * smiles: ** CCCCCC=CCC=CCC=CCC=CCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=CHD-RXN CHD-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17324 CPD-17324] ==
* direction:
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* smiles:
** REVERSIBLE
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** CCCCCC=CCC=CCC=CCC=CCCCC(=O)CC(=O)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-]
 
* common name:
 
* common name:
** glucose-methanol-choline_oxidoreductase
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** 3-oxo adrenoyl-CoA
* ec number:
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* inchi key:
** [http://enzyme.expasy.org/EC/1.1.99.1 EC-1.1.99.1]
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** InChIKey=VMAJWSSWCPBIJY-KPOVBLHLSA-J
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* molecular weight:
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** 1091.996   
 
* Synonym(s):
 
* Synonym(s):
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** 3-oxo-(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyl-CoA
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** 3-oxo-(7Z,10Z,13Z,16Z)-docosatetraenoyl-CoA
  
== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
* With identifiers:
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* [[RXN-16112]]
** 1 [[Acceptor]][c] '''+''' 1 [[CHOLINE]][c] '''<=>''' 1 [[BETAINE_ALDEHYDE]][c] '''+''' 1 [[Donor-H2]][c]
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== Reaction(s) known to produce the compound ==
* With common name(s):
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== Reaction(s) of unknown directionality ==
** 1 an oxidized electron acceptor[c] '''+''' 1 choline[c] '''<=>''' 1 betaine aldehyde[c] '''+''' 1 a reduced electron acceptor[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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* [[Tiso_gene_16765]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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== Pathways  ==
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* [[BETSYN-PWY]], glycine betaine biosynthesis I (Gram-negative bacteria): [http://metacyc.org/META/NEW-IMAGE?object=BETSYN-PWY BETSYN-PWY]
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** '''2''' reactions found over '''2''' reactions in the full pathway
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* [[CHOLINE-BETAINE-ANA-PWY]], choline degradation I: [http://metacyc.org/META/NEW-IMAGE?object=CHOLINE-BETAINE-ANA-PWY CHOLINE-BETAINE-ANA-PWY]
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** '''2''' reactions found over '''2''' reactions in the full pathway
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== Reconstruction information  ==
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* [[annotation]]:
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** [[pathwaytools]]:
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*** [[in-silico_annotation]]
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== External links  ==
 
== External links  ==
* RHEA:
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* PUBCHEM:
** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=17433 17433]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=71581099 71581099]
* LIGAND-RXN:
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* CHEBI:
** [http://www.genome.jp/dbget-bin/www_bget?R01025 R01025]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=73852 73852]
* UNIPROT:
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{{#set: smiles=CCCCCC=CCC=CCC=CCC=CCCCC(=O)CC(=O)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-]}}
** [http://www.uniprot.org/uniprot/P17444 P17444]
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{{#set: common name=3-oxo adrenoyl-CoA}}
{{#set: direction=REVERSIBLE}}
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{{#set: inchi key=InChIKey=VMAJWSSWCPBIJY-KPOVBLHLSA-J}}
{{#set: common name=glucose-methanol-choline_oxidoreductase}}
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{{#set: molecular weight=1091.996    }}
{{#set: ec number=EC-1.1.99.1}}
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{{#set: common name=3-oxo-(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyl-CoA|3-oxo-(7Z,10Z,13Z,16Z)-docosatetraenoyl-CoA}}
{{#set: gene associated=Tiso_gene_16765}}
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{{#set: consumed by=RXN-16112}}
{{#set: in pathway=BETSYN-PWY|CHOLINE-BETAINE-ANA-PWY}}
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{{#set: reconstruction category=annotation}}
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: reconstruction source=in-silico_annotation}}
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Latest revision as of 19:32, 21 March 2018

Metabolite CPD-17324

  • smiles:
    • CCCCCC=CCC=CCC=CCC=CCCCC(=O)CC(=O)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-]
  • common name:
    • 3-oxo adrenoyl-CoA
  • inchi key:
    • InChIKey=VMAJWSSWCPBIJY-KPOVBLHLSA-J
  • molecular weight:
    • 1091.996
  • Synonym(s):
    • 3-oxo-(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyl-CoA
    • 3-oxo-(7Z,10Z,13Z,16Z)-docosatetraenoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCC=CCC=CCC=CCC=CCCCC(=O)CC(=O)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-" cannot be used as a page name in this wiki.