Difference between revisions of "Ec-10 005810"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-1103 CPD-1103] == * smiles: ** C(C(C1(C=CC(=CC=1)O))OC2(OC(C(C(C2O)O)O)CO))#N * inchi key:...")
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[[Category:Pathway]]
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[[Category:Metabolite]]
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== Pathway [http://metacyc.org/META/NEW-IMAGE?object=PWY-6792 PWY-6792] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-1103 CPD-1103] ==
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* taxonomic range:
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* smiles:
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** [http://metacyc.org/META/NEW-IMAGE?object=TAX-33090 TAX-33090]
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** C(C(C1(C=CC(=CC=1)O))OC2(OC(C(C(C2O)O)O)CO))#N
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* inchi key:
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** InChIKey=NVLTYOJHPBMILU-GMDXDWKASA-N
 
* common name:
 
* common name:
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** scopoletin biosynthesis
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** taxiphyllin
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* molecular weight:
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** 311.291   
 
* Synonym(s):
 
* Synonym(s):
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** (R)-4-hydroxymandelonitrile β-D-glucoside
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** (2R)-(β-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile
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** (R)-alpha-(β-D-glucopyranosyloxy)-4-hydroxybenzeneacetonitrile
  
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== Reaction(s) found ==
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== Reaction(s) known to consume the compound ==
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'''1''' reactions found over '''3''' reactions in the full pathway
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* [[RXN-13600]]
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* [[CAFFEOYL-COA-O-METHYLTRANSFERASE-RXN]]
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== Reaction(s) known to produce the compound ==
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== Reaction(s) not found ==
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== Reaction(s) of unknown directionality ==
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* [http://metacyc.org/META/NEW-IMAGE?object=RXN-12349 RXN-12349]
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* [http://metacyc.org/META/NEW-IMAGE?object=RXN-12350 RXN-12350]
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== External links  ==
 
== External links  ==
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{{#set: taxonomic range=TAX-33090}}
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* CAS : 21401-21-8
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{{#set: common name=scopoletin biosynthesis}}
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* PUBCHEM:
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{{#set: reaction found=1}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=107721 107721]
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{{#set: reaction not found=3}}
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* HMDB : HMDB30704
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{{#set: completion rate=33.0}}
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* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C01855 C01855]
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* CHEMSPIDER:
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** [http://www.chemspider.com/Chemical-Structure.96890.html 96890]
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* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16267 16267]
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{{#set: smiles=C(C(C1(C=CC(=CC=1)O))OC2(OC(C(C(C2O)O)O)CO))#N}}
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{{#set: inchi key=InChIKey=NVLTYOJHPBMILU-GMDXDWKASA-N}}
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{{#set: common name=taxiphyllin}}
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{{#set: molecular weight=311.291    }}
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{{#set: common name=(R)-4-hydroxymandelonitrile β-D-glucoside|(2R)-(β-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile|(R)-alpha-(β-D-glucopyranosyloxy)-4-hydroxybenzeneacetonitrile}}
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{{#set: consumed by=RXN-13600}}

Revision as of 21:09, 17 March 2018

Metabolite CPD-1103

  • smiles:
    • C(C(C1(C=CC(=CC=1)O))OC2(OC(C(C(C2O)O)O)CO))#N
  • inchi key:
    • InChIKey=NVLTYOJHPBMILU-GMDXDWKASA-N
  • common name:
    • taxiphyllin
  • molecular weight:
    • 311.291
  • Synonym(s):
    • (R)-4-hydroxymandelonitrile β-D-glucoside
    • (2R)-(β-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile
    • (R)-alpha-(β-D-glucopyranosyloxy)-4-hydroxybenzeneacetonitrile

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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