Difference between revisions of "CPD-14596"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=LIGNOSTILBENE-ALPHA-BETA-DIOXYGENASE-RXN LIGNOSTILBENE-ALPHA-BETA-DIOXYGENASE-RXN] == * direction:...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14596 CPD-14596] == * smiles: ** CCC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=LIGNOSTILBENE-ALPHA-BETA-DIOXYGENASE-RXN LIGNOSTILBENE-ALPHA-BETA-DIOXYGENASE-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14596 CPD-14596] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CCC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C
 
* common name:
 
* common name:
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** 9-cis-epoxycarotenoid_neoxanthin_cleavage_enzyme-like_protein
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** neolinustatin
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* ec number:
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* inchi key:
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** [http://enzyme.expasy.org/EC/1.13.11.43 EC-1.13.11.43]
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** InChIKey=WOSYVGNDRYBQCQ-BARGLTKPSA-N
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* molecular weight:
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** 423.416   
 
* Synonym(s):
 
* Synonym(s):
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** butanenitrile
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** [(2R)-2-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyloxy)-2-methylbutyronitrile)]
  
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== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
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* With identifiers:
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* [[RXN-13603]]
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** 1 [[12-BIS4-HYDROXY-3-METHOXYPHENYLETHYLE]][c] '''+''' 1 [[OXYGEN-MOLECULE]][c] '''=>''' 2 [[VANILLIN]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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** 1 4,4'-dihydroxy-3,3'-dimethoxystilbene[c] '''+''' 1 oxygen[c] '''=>''' 2 vanillin[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_7740]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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== Pathways  ==
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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  ==
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* RHEA:
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* LIGAND-CPD:
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=21340 21340]
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** [http://www.genome.jp/dbget-bin/www_bget?C08336 C08336]
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* LIGAND-RXN:
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* HMDB : HMDB38482
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** [http://www.genome.jp/dbget-bin/www_bget?R00043 R00043]
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* CHEBI:
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* UNIPROT:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=7506 7506]
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** [http://www.uniprot.org/uniprot/Q52008 Q52008]
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* PUBCHEM:
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** [http://www.uniprot.org/uniprot/Q53353 Q53353]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=119533 119533]
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{{#set: direction=LEFT-TO-RIGHT}}
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{{#set: smiles=CCC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C}}
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{{#set: common name=9-cis-epoxycarotenoid_neoxanthin_cleavage_enzyme-like_protein}}
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{{#set: common name=neolinustatin}}
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{{#set: ec number=EC-1.13.11.43}}
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{{#set: inchi key=InChIKey=WOSYVGNDRYBQCQ-BARGLTKPSA-N}}
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{{#set: gene associated=Tiso_gene_7740}}
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{{#set: molecular weight=423.416    }}
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{{#set: in pathway=}}
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{{#set: common name=butanenitrile|[(2R)-2-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyloxy)-2-methylbutyronitrile)]}}
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{{#set: reconstruction category=annotation}}
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{{#set: consumed by=RXN-13603}}
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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 21:22, 21 March 2018

Metabolite CPD-14596

  • smiles:
    • CCC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C
  • common name:
    • neolinustatin
  • inchi key:
    • InChIKey=WOSYVGNDRYBQCQ-BARGLTKPSA-N
  • molecular weight:
    • 423.416
  • Synonym(s):
    • butanenitrile
    • [(2R)-2-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyloxy)-2-methylbutyronitrile)]

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links




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