Difference between revisions of "CPD-2752"

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(Created page with "Category:metabolite == Metabolite CPDMETA-13651 == * common-name: ** perakine * smiles: ** cc3(n5(c2(c1(=nc6(=cc=cc=c(c41(c(c(c(c2)c(c=o)3)c(c4)5)oc(=o)c))6))))) * inchi-k...")
(Created page with "Category:metabolite == Metabolite CPD-2752 == * common-name: ** trans-3-hydroxycotinine-glucuronide * smiles: ** c2(=o)(c(oc1(c(c(c(c(o1)c([o-])=o)o)o)o))c[ch](n(c)2)c3(=c...")
 
(4 intermediate revisions by 2 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPDMETA-13651 ==
+
== Metabolite CPD-2752 ==
 
* common-name:
 
* common-name:
** perakine
+
** trans-3-hydroxycotinine-glucuronide
 
* smiles:
 
* smiles:
** cc3(n5(c2(c1(=nc6(=cc=cc=c(c41(c(c(c(c2)c(c=o)3)c(c4)5)oc(=o)c))6)))))
+
** c2(=o)(c(oc1(c(c(c(c(o1)c([o-])=o)o)o)o))c[ch](n(c)2)c3(=cn=cc=c3))
 
* inchi-key:
 
* inchi-key:
** gdxjmogwonjrhl-vqhwpedhsa-n
+
** walnnkzughysct-mbwyjtgfsa-m
 
* molecular-weight:
 
* molecular-weight:
** 350.416
+
** 367.335
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-12673]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN66-162]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=perakine}}
+
{{#set: common-name=trans-3-hydroxycotinine-glucuronide}}
{{#set: inchi-key=inchikey=gdxjmogwonjrhl-vqhwpedhsa-n}}
+
{{#set: inchi-key=inchikey=walnnkzughysct-mbwyjtgfsa-m}}
{{#set: molecular-weight=350.416}}
+
{{#set: molecular-weight=367.335}}

Latest revision as of 11:13, 18 March 2021

Metabolite CPD-2752

  • common-name:
    • trans-3-hydroxycotinine-glucuronide
  • smiles:
    • c2(=o)(c(oc1(c(c(c(c(o1)c([o-])=o)o)o)o))c[ch](n(c)2)c3(=cn=cc=c3))
  • inchi-key:
    • walnnkzughysct-mbwyjtgfsa-m
  • molecular-weight:
    • 367.335

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality