Difference between revisions of "1-O-SINAPOYL-BETA-D-GLUCOSE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=1-O-SINAPOYL-BETA-D-GLUCOSE 1-O-SINAPOYL-BETA-D-GLUCOSE] == * smiles: ** COC2(=CC(C=CC(=O)OC1(C...")
 
 
Line 3: Line 3:
 
* smiles:
 
* smiles:
 
** COC2(=CC(C=CC(=O)OC1(C(O)C(C(C(O1)CO)O)O))=CC(=C(O)2)OC)
 
** COC2(=CC(C=CC(=O)OC1(C(O)C(C(C(O1)CO)O)O))=CC(=C(O)2)OC)
−
* common name:
 
−
** 1-O-sinapoyl-β-D-glucose
 
−
* inchi key:
 
−
** InChIKey=XRKBRPFTFKKHEF-DGDBGZAXSA-N
 
 
* molecular weight:
 
* molecular weight:
 
** 386.355     
 
** 386.355     
 +
* inchi key:
 +
** InChIKey=XRKBRPFTFKKHEF-DGDBGZAXSA-N
 +
* common name:
 +
** 1-O-sinapoyl-β-D-glucose
 
* Synonym(s):
 
* Synonym(s):
 
** 1-O-sinapoyl β-D-glucoside
 
** 1-O-sinapoyl β-D-glucoside
Line 17: Line 17:
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* METABOLIGHTS : MTBLC16546
 
* PUBCHEM:
 
* PUBCHEM:
 
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5280406 5280406]
 
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5280406 5280406]
−
* CHEMSPIDER:
 
−
** [http://www.chemspider.com/Chemical-Structure.4444086.html 4444086]
 
 
* CHEBI:
 
* CHEBI:
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16546 16546]
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16546 16546]
−
* METABOLIGHTS : MTBLC16546
 
 
* LIGAND-CPD:
 
* LIGAND-CPD:
 
** [http://www.genome.jp/dbget-bin/www_bget?C01175 C01175]
 
** [http://www.genome.jp/dbget-bin/www_bget?C01175 C01175]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.4444086.html 4444086]
 
{{#set: smiles=COC2(=CC(C=CC(=O)OC1(C(O)C(C(C(O1)CO)O)O))=CC(=C(O)2)OC)}}
 
{{#set: smiles=COC2(=CC(C=CC(=O)OC1(C(O)C(C(C(O1)CO)O)O))=CC(=C(O)2)OC)}}
−
{{#set: common name=1-O-sinapoyl-β-D-glucose}}
 
−
{{#set: inchi key=InChIKey=XRKBRPFTFKKHEF-DGDBGZAXSA-N}}
 
 
{{#set: molecular weight=386.355    }}
 
{{#set: molecular weight=386.355    }}
 +
{{#set: inchi key=InChIKey=XRKBRPFTFKKHEF-DGDBGZAXSA-N}}
 +
{{#set: common name=1-O-sinapoyl-β-D-glucose}}
 
{{#set: common name=1-O-sinapoyl β-D-glucoside}}
 
{{#set: common name=1-O-sinapoyl β-D-glucoside}}
 
{{#set: consumed by=2.3.1.91-RXN}}
 
{{#set: consumed by=2.3.1.91-RXN}}

Latest revision as of 16:25, 10 January 2019

Metabolite 1-O-SINAPOYL-BETA-D-GLUCOSE

  • smiles:
    • COC2(=CC(C=CC(=O)OC1(C(O)C(C(C(O1)CO)O)O))=CC(=C(O)2)OC)
  • molecular weight:
    • 386.355
  • inchi key:
    • InChIKey=XRKBRPFTFKKHEF-DGDBGZAXSA-N
  • common name:
    • 1-O-sinapoyl-β-D-glucose
  • Synonym(s):
    • 1-O-sinapoyl β-D-glucoside

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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