Difference between revisions of "CPDMETA-13651"

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(Created page with "Category:metabolite == Metabolite CPD-3618 == * common-name: ** 2-oxovalerate * smiles: ** cccc(=o)c(=o)[o-] * inchi-key: ** kdvfrmmrzocfls-uhfffaoysa-m * molecular-weight...")
(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...")
 
(2 intermediate revisions by 2 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-3618 ==
+
== Metabolite CPDMETA-13651 ==
 
* common-name:
 
* common-name:
** 2-oxovalerate
+
** perakine
 
* smiles:
 
* smiles:
** cccc(=o)c(=o)[o-]
+
** 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-key:
 
* inchi-key:
** kdvfrmmrzocfls-uhfffaoysa-m
+
** gdxjmogwonjrhl-vqhwpedhsa-n
 
* molecular-weight:
 
* molecular-weight:
** 115.108
+
** 350.416
 
== 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 ==
* [[RXN-14986]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=2-oxovalerate}}
+
{{#set: common-name=perakine}}
{{#set: inchi-key=inchikey=kdvfrmmrzocfls-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=gdxjmogwonjrhl-vqhwpedhsa-n}}
{{#set: molecular-weight=115.108}}
+
{{#set: molecular-weight=350.416}}

Latest revision as of 11:13, 18 March 2021

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-key:
    • gdxjmogwonjrhl-vqhwpedhsa-n
  • molecular-weight:
    • 350.416

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality