Difference between revisions of "CPD-7367"

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(Created page with "Category:metabolite == Metabolite OROTATE == * common-name: ** orotate * smiles: ** c1(=c(c([o-])=o)nc(nc(=o)1)=o) * inchi-key: ** pxqpewdeaktcgb-uhfffaoysa-m * molecular-...")
(Created page with "Category:metabolite == Metabolite CPD-19491 == * common-name: ** 3-isopropyl-6-(methylthio)-2-oxohexanoate * smiles: ** c(c(cccsc)c(=o)c(=o)[o-])(=o)[o-] * inchi-key: ** w...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite OROTATE ==
+
== Metabolite CPD-19491 ==
 
* common-name:
 
* common-name:
** orotate
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** 3-isopropyl-6-(methylthio)-2-oxohexanoate
 
* smiles:
 
* smiles:
** c1(=c(c([o-])=o)nc(nc(=o)1)=o)
+
** c(c(cccsc)c(=o)c(=o)[o-])(=o)[o-]
 
* inchi-key:
 
* inchi-key:
** pxqpewdeaktcgb-uhfffaoysa-m
+
** wrgktdwhjsbcjr-uhfffaoysa-l
 
* molecular-weight:
 
* molecular-weight:
** 155.09
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** 218.224
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[OROPRIBTRANS-RXN]]
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* [[RXN-18208]]
* [[ORPRT]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[DIHYDROOROTATE-DEHYDROGENASE-RXN]]
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* [[RXN-18208]]
* [[OROPRIBTRANS-RXN]]
 
* [[ORPRT]]
 
* [[RXN0-6491]]
 
* [[RXN0-6554]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=orotate}}
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{{#set: common-name=3-isopropyl-6-(methylthio)-2-oxohexanoate}}
{{#set: inchi-key=inchikey=pxqpewdeaktcgb-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=wrgktdwhjsbcjr-uhfffaoysa-l}}
{{#set: molecular-weight=155.09}}
+
{{#set: molecular-weight=218.224}}

Revision as of 14:54, 5 January 2021

Metabolite CPD-19491

  • common-name:
    • 3-isopropyl-6-(methylthio)-2-oxohexanoate
  • smiles:
    • c(c(cccsc)c(=o)c(=o)[o-])(=o)[o-]
  • inchi-key:
    • wrgktdwhjsbcjr-uhfffaoysa-l
  • molecular-weight:
    • 218.224

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality