Difference between revisions of "CPD-6242"

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(Created page with "Category:metabolite == Metabolite CPDQT-40 == * common-name: ** 3-[(7'-methylthio)heptyl]malate * smiles: ** cscccccccc(c(o)c(=o)[o-])c(=o)[o-] * inchi-key: ** sxljfgxgvbw...")
(Created page with "Category:metabolite == Metabolite QUINOLINATE == * common-name: ** quinolinate * smiles: ** c1(=cc=c(c(c([o-])=o)=n1)c([o-])=o) * inchi-key: ** gjawhxhkyyxbsv-uhfffaoysa-l...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPDQT-40 ==
+
== Metabolite QUINOLINATE ==
 
* common-name:
 
* common-name:
** 3-[(7'-methylthio)heptyl]malate
+
** quinolinate
 
* smiles:
 
* smiles:
** cscccccccc(c(o)c(=o)[o-])c(=o)[o-]
+
** c1(=cc=c(c(c([o-])=o)=n1)c([o-])=o)
 
* inchi-key:
 
* inchi-key:
** sxljfgxgvbwoob-uhfffaoysa-l
+
** gjawhxhkyyxbsv-uhfffaoysa-l
 
* molecular-weight:
 
* molecular-weight:
** 276.347
+
** 165.105
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-18200]]
+
* [[QUINOPRIBOTRANS-RXN]]
* [[RXNQT-4178]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-18200]]
+
* [[QUINOLINATE-SYNTHA-RXN]]
 +
* [[QUINOLINATE-SYNTHE-MULTI-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3-[(7'-methylthio)heptyl]malate}}
+
{{#set: common-name=quinolinate}}
{{#set: inchi-key=inchikey=sxljfgxgvbwoob-uhfffaoysa-l}}
+
{{#set: inchi-key=inchikey=gjawhxhkyyxbsv-uhfffaoysa-l}}
{{#set: molecular-weight=276.347}}
+
{{#set: molecular-weight=165.105}}

Revision as of 14:57, 5 January 2021

Metabolite QUINOLINATE

  • common-name:
    • quinolinate
  • smiles:
    • c1(=cc=c(c(c([o-])=o)=n1)c([o-])=o)
  • inchi-key:
    • gjawhxhkyyxbsv-uhfffaoysa-l
  • molecular-weight:
    • 165.105

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality