Difference between revisions of "CPD-17545"

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(Created page with "Category:metabolite == Metabolite CPD-110 == * common-name: ** salicylate * smiles: ** c(c1(=cc=cc=c1o))([o-])=o * inchi-key: ** ygsdefsmjlzeoe-uhfffaoysa-m * molecular-we...")
(Created page with "Category:metabolite == Metabolite CPD-17545 == * common-name: ** 3-({[(2r,3r)-3-carbamoyloxiran-2-yl]carbonyl}amino)-l-alanine * smiles: ** c([n+])c(c([o-])=o)nc(=o)c1(oc(...")
 
(6 intermediate revisions by 3 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-110 ==
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== Metabolite CPD-17545 ==
 
* common-name:
 
* common-name:
** salicylate
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** 3-({[(2r,3r)-3-carbamoyloxiran-2-yl]carbonyl}amino)-l-alanine
 
* smiles:
 
* smiles:
** c(c1(=cc=cc=c1o))([o-])=o
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** c([n+])c(c([o-])=o)nc(=o)c1(oc(c(=o)n)1)
 
* inchi-key:
 
* inchi-key:
** ygsdefsmjlzeoe-uhfffaoysa-m
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** neroffugairxgm-wxjvfsnfsa-n
 
* molecular-weight:
 
* molecular-weight:
** 137.115
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** 217.181
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[SALICYLATE-1-MONOOXYGENASE-RXN]]
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* [[RXN-16294]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXNQT-4366]]
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* [[RXN-16294]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=salicylate}}
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{{#set: common-name=3-({[(2r,3r)-3-carbamoyloxiran-2-yl]carbonyl}amino)-l-alanine}}
{{#set: inchi-key=inchikey=ygsdefsmjlzeoe-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=neroffugairxgm-wxjvfsnfsa-n}}
{{#set: molecular-weight=137.115}}
+
{{#set: molecular-weight=217.181}}

Latest revision as of 11:13, 18 March 2021

Metabolite CPD-17545

  • common-name:
    • 3-({[(2r,3r)-3-carbamoyloxiran-2-yl]carbonyl}amino)-l-alanine
  • smiles:
    • c([n+])c(c([o-])=o)nc(=o)c1(oc(c(=o)n)1)
  • inchi-key:
    • neroffugairxgm-wxjvfsnfsa-n
  • molecular-weight:
    • 217.181

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

Property "Common-name" (as page type) with input value "3-({[(2r,3r)-3-carbamoyloxiran-2-yl]carbonyl}amino)-l-alanine" contains invalid characters or is incomplete and therefore can cause unexpected results during a query or annotation process.