Difference between revisions of "CPD-17624"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-12078 RXN-12078] == * direction: ** REVERSIBLE * common name: ** oxidoreductase ** aldose_reduc...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17624 CPD-17624] == * smiles: ** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCC=CCCCCCCCC(=O)[O-]...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-12078 RXN-12078] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17624 CPD-17624] ==
* direction:
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* smiles:
** REVERSIBLE
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** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCC=CCCCCCCCC(=O)[O-])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:
** oxidoreductase
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** ω-carboxy-(9Z)-octadec-9-enoyl-CoA
** aldose_reductase
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* inchi key:
** aldo_keto_reductase
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** InChIKey=IISWKVFHQLAOMW-BTFUZUOASA-I
* ec number:
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* molecular weight:
** [http://enzyme.expasy.org/EC/1.1.1.21 EC-1.1.1.21]
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** 1056.928   
 
* Synonym(s):
 
* Synonym(s):
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** 18-carboxyl oleoyl-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 [[GALACTITOL]][c] '''+''' 1 [[NADP]][c] '''<=>''' 1 [[NADPH]][c] '''+''' 1 [[PROTON]][c] '''+''' 1 [[D-galactopyranose]][c]
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* [[RXN-16418]]
* With common name(s):
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== Reaction(s) of unknown directionality ==
** 1 galactitol[c] '''+''' 1 NADP+[c] '''<=>''' 1 NADPH[c] '''+''' 1 H+[c] '''+''' 1 D-galactopyranose[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_7800]]
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** IN-SILICO_ANNOTATION
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***AUTOMATED-NAME-MATCH
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* [[Tiso_gene_8988]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_7799]]
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** IN-SILICO_ANNOTATION
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***AUTOMATED-NAME-MATCH
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* [[Tiso_gene_18748]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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== Pathways  ==
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* [[PWY-6693]], D-galactose degradation IV: [http://metacyc.org/META/NEW-IMAGE?object=PWY-6693 PWY-6693]
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** '''1''' reactions found over '''3''' 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  ==
* LIGAND-RXN:
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* PUBCHEM:
** [http://www.genome.jp/dbget-bin/www_bget?R01095 R01095]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91820430 91820430]
{{#set: direction=REVERSIBLE}}
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{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCC=CCCCCCCCC(=O)[O-])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-]}}
{{#set: common name=oxidoreductase}}
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{{#set: common name=&omega;-carboxy-(9Z)-octadec-9-enoyl-CoA}}
{{#set: common name=aldose_reductase}}
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{{#set: inchi key=InChIKey=IISWKVFHQLAOMW-BTFUZUOASA-I}}
{{#set: common name=aldo_keto_reductase}}
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{{#set: molecular weight=1056.928    }}
{{#set: ec number=EC-1.1.1.21}}
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{{#set: common name=18-carboxyl oleoyl-CoA}}
{{#set: gene associated=Tiso_gene_7800|Tiso_gene_8988|Tiso_gene_7799|Tiso_gene_18748}}
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{{#set: produced by=RXN-16418}}
{{#set: in pathway=PWY-6693}}
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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 20:17, 21 March 2018

Metabolite CPD-17624

  • smiles:
    • CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCC=CCCCCCCCC(=O)[O-])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:
    • ω-carboxy-(9Z)-octadec-9-enoyl-CoA
  • inchi key:
    • InChIKey=IISWKVFHQLAOMW-BTFUZUOASA-I
  • molecular weight:
    • 1056.928
  • Synonym(s):
    • 18-carboxyl oleoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCC=CCCCCCCCC(=O)[O-])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.