Difference between revisions of "CPD-10260"

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(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...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10260 CPD-10260] == * smiles: ** CCCCCCCCCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-16622 RXN-16622] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10260 CPD-10260] ==
* 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
 
* common name:
 
* common name:
** 3-oxoacyl-(acyl-carrier-protein)
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** 3-oxo-stearoyl-CoA
* ec number:
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* inchi key:
** [http://enzyme.expasy.org/EC/1.1.1.100 EC-1.1.1.100]
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** InChIKey=LGOGWHDPDVAUNY-LFZQUHGESA-J
 +
* molecular weight:
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** 1043.952   
 
* Synonym(s):
 
* Synonym(s):
 +
** 3-Oxooctadecanoyl-CoA
  
== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
* With identifiers:
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* [[RXN-9544]]
** 1 [[7Z-3-oxo-hexadec-7-enoyl-ACPs]][c] '''+''' 1 [[PROTON]][c] '''+''' 1 [[NADPH]][c] '''=>''' 1 [[NADP]][c] '''+''' 1 [[3R-7Z-3-hydroxy-hexadec-7-enoyl-ACPs]][c]
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== Reaction(s) known to produce the compound ==
* With common name(s):
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* [[RXN-9543]]
** 1 a (7Z)-3-oxo-hexadec-7-enoyl-[acp][c] '''+''' 1 H+[c] '''+''' 1 NADPH[c] '''=>''' 1 NADP+[c] '''+''' 1 a (3R,7Z)-3-hydroxy-hexadec-7-enoyl-[acp][c]
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== Reaction(s) of unknown directionality ==
 
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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_13083]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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** EXPERIMENTAL_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_9885]]
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** EXPERIMENTAL_ANNOTATION
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***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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* [[annotation]]:
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** [[pathwaytools]]:
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*** [[experimental_annotation]]
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*** [[in-silico_annotation]]
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== External links  ==
 
== External links  ==
{{#set: direction=LEFT-TO-RIGHT}}
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* LIGAND-CPD:
{{#set: common name=3-oxoacyl-(acyl-carrier-protein)}}
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** [http://www.genome.jp/dbget-bin/www_bget?C16216 C16216]
{{#set: ec number=EC-1.1.1.100}}
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* HMDB : HMDB06498
{{#set: gene associated=Tiso_gene_13083|Tiso_gene_9885}}
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* CHEBI:
{{#set: in pathway=PWY-7664}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=71407 71407]
{{#set: reconstruction category=annotation}}
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* BIGG : 3oodcoa
{{#set: reconstruction tool=pathwaytools}}
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* PUBCHEM:
{{#set: reconstruction source=experimental_annotation|in-silico_annotation}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25243996 25243996]
 +
{{#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: common name=3-oxo-stearoyl-CoA}}
 +
{{#set: inchi key=InChIKey=LGOGWHDPDVAUNY-LFZQUHGESA-J}}
 +
{{#set: molecular weight=1043.952    }}
 +
{{#set: common name=3-Oxooctadecanoyl-CoA}}
 +
{{#set: consumed by=RXN-9544}}
 +
{{#set: produced by=RXN-9543}}

Latest revision as of 20:19, 21 March 2018

Metabolite CPD-10260

  • 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:
    • 3-oxo-stearoyl-CoA
  • inchi key:
    • InChIKey=LGOGWHDPDVAUNY-LFZQUHGESA-J
  • molecular weight:
    • 1043.952
  • Synonym(s):
    • 3-Oxooctadecanoyl-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.