Difference between revisions of "PWY-5966"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2500 CPD0-2500] == * smiles: ** C(O)C2(C(O)C(O)C(O)C(OC1(C=CC(=CC=1)[N+]([O-])=O))O2) * in...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3457-TETRAHYDROXY-3-METHOXYFLAVONE 3457-TETRAHYDROXY-3-METHOXYFLAVONE] == * smiles: ** COC3(C(=...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2500 CPD0-2500] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3457-TETRAHYDROXY-3-METHOXYFLAVONE 3457-TETRAHYDROXY-3-METHOXYFLAVONE] ==
 
* smiles:
 
* smiles:
−
** C(O)C2(C(O)C(O)C(O)C(OC1(C=CC(=CC=1)[N+]([O-])=O))O2)
+
** COC3(C(=O)C1(C(=CC([O-])=CC(O)=1)OC(C2(C=C(O)C(O)=CC=2))=3))
 
* inchi key:
 
* inchi key:
−
** InChIKey=IFBHRQDFSNCLOZ-IIRVCBMXSA-N
+
** InChIKey=WEPBGSIAWZTEJR-UHFFFAOYSA-M
 
* common name:
 
* common name:
−
** p-nitrophenyl-α-D-galactopyranoside
+
** 3-O-methylquercetin
 
* molecular weight:
 
* molecular weight:
−
** 301.252    
+
** 315.259    
 
* Synonym(s):
 
* Synonym(s):
−
** 4-nitrophenyl-α-D-galactopyranoside
+
** 3-methoxy-5,7,3',4'-tetrahydroxyflavone
−
** 4-nitrophenyl-α-D-galactoside
+
** 3-methoxyluteolin
−
** p-nitrophenyl-α-D-galactoside
+
** 3',4',5,7-tetrahydroxy-3-methoxyflavone
−
** pNPαGal
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-17830]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[QUERCETIN-3-O-METHYLTRANSFERASE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=82000 82000]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25202270 25202270]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=546840 546840]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57928 57928]
−
{{#set: smiles=C(O)C2(C(O)C(O)C(O)C(OC1(C=CC(=CC=1)[N+]([O-])=O))O2)}}
+
* LIGAND-CPD:
−
{{#set: inchi key=InChIKey=IFBHRQDFSNCLOZ-IIRVCBMXSA-N}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C04443 C04443]
−
{{#set: common name=p-nitrophenyl-α-D-galactopyranoside}}
+
{{#set: smiles=COC3(C(=O)C1(C(=CC([O-])=CC(O)=1)OC(C2(C=C(O)C(O)=CC=2))=3))}}
−
{{#set: molecular weight=301.252   }}
+
{{#set: inchi key=InChIKey=WEPBGSIAWZTEJR-UHFFFAOYSA-M}}
−
{{#set: common name=4-nitrophenyl-α-D-galactopyranoside|4-nitrophenyl-α-D-galactoside|p-nitrophenyl-α-D-galactoside|pNPαGal}}
+
{{#set: common name=3-O-methylquercetin}}
−
{{#set: consumed by=RXN-17830}}
+
{{#set: molecular weight=315.259   }}
 +
{{#set: common name=3-methoxy-5,7,3',4'-tetrahydroxyflavone|3-methoxyluteolin|3',4',5,7-tetrahydroxy-3-methoxyflavone}}
 +
{{#set: produced by=QUERCETIN-3-O-METHYLTRANSFERASE-RXN}}

Revision as of 16:04, 10 January 2018

Metabolite 3457-TETRAHYDROXY-3-METHOXYFLAVONE

  • smiles:
    • COC3(C(=O)C1(C(=CC([O-])=CC(O)=1)OC(C2(C=C(O)C(O)=CC=2))=3))
  • inchi key:
    • InChIKey=WEPBGSIAWZTEJR-UHFFFAOYSA-M
  • common name:
    • 3-O-methylquercetin
  • molecular weight:
    • 315.259
  • Synonym(s):
    • 3-methoxy-5,7,3',4'-tetrahydroxyflavone
    • 3-methoxyluteolin
    • 3',4',5,7-tetrahydroxy-3-methoxyflavone

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"COC3(C(=O)C1(C(=CC([O-])=CC(O)=1)OC(C2(C=C(O)C(O)=CC=2))=3))" cannot be used as a page name in this wiki.



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