Difference between revisions of "CPD-8078"

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(Created page with "Category:metabolite == Metabolite CPD-782 == * common-name: ** 3,4-dihydroxyphenylacetate * smiles: ** c([o-])(=o)cc1(c=cc(=c(c=1)o)o) * inchi-key: ** cffzdzcdufsofz-uhfff...")
(Created page with "Category:metabolite == Metabolite CPD-9152 == * common-name: ** 4-chlorocatechol * smiles: ** c1(c=c(c(=cc=1cl)o)o) * inchi-key: ** wwobypkuyodhdg-uhfffaoysa-n * molecular...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-782 ==
+
== Metabolite CPD-9152 ==
 
* common-name:
 
* common-name:
** 3,4-dihydroxyphenylacetate
+
** 4-chlorocatechol
 
* smiles:
 
* smiles:
** c([o-])(=o)cc1(c=cc(=c(c=1)o)o)
+
** c1(c=c(c(=cc=1cl)o)o)
 
* inchi-key:
 
* inchi-key:
** cffzdzcdufsofz-uhfffaoysa-m
+
** wwobypkuyodhdg-uhfffaoysa-n
 
* molecular-weight:
 
* molecular-weight:
** 167.141
+
** 144.557
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN6666-5]]
+
* [[RXN-9912]]
 +
* [[RXN-9914]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3,4-dihydroxyphenylacetate}}
+
{{#set: common-name=4-chlorocatechol}}
{{#set: inchi-key=inchikey=cffzdzcdufsofz-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=wwobypkuyodhdg-uhfffaoysa-n}}
{{#set: molecular-weight=167.141}}
+
{{#set: molecular-weight=144.557}}

Revision as of 08:31, 15 March 2021

Metabolite CPD-9152

  • common-name:
    • 4-chlorocatechol
  • smiles:
    • c1(c=c(c(=cc=1cl)o)o)
  • inchi-key:
    • wwobypkuyodhdg-uhfffaoysa-n
  • molecular-weight:
    • 144.557

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality