Difference between revisions of "SINAPATE"

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(Created page with "Category:metabolite == Metabolite 1-7-DIMETHYLXANTHINE == * common-name: ** paraxanthine * smiles: ** cn2(c=nc1(=c(c(n(c(n1)=o)c)=o)2)) * inchi-key: ** qunwudvfrngtco-uhff...")
(Created page with "Category:metabolite == Metabolite SINAPATE == * common-name: ** sinapate * smiles: ** coc1(c=c(c=c(oc)c(o)=1)c=cc([o-])=o) * inchi-key: ** pcmortlopmlefb-onegzznksa-m * mo...")
 
(2 intermediate revisions by one other user not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite 1-7-DIMETHYLXANTHINE ==
+
== Metabolite SINAPATE ==
 
* common-name:
 
* common-name:
** paraxanthine
+
** sinapate
 
* smiles:
 
* smiles:
** cn2(c=nc1(=c(c(n(c(n1)=o)c)=o)2))
+
** coc1(c=c(c=c(oc)c(o)=1)c=cc([o-])=o)
 
* inchi-key:
 
* inchi-key:
** qunwudvfrngtco-uhfffaoysa-n
+
** pcmortlopmlefb-onegzznksa-m
 
* molecular-weight:
 
* molecular-weight:
** 180.166
+
** 223.205
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-11520]]
+
* [[RXN-10919]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-3422]]
 +
* [[RXN-8014]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=paraxanthine}}
+
{{#set: common-name=sinapate}}
{{#set: inchi-key=inchikey=qunwudvfrngtco-uhfffaoysa-n}}
+
{{#set: inchi-key=inchikey=pcmortlopmlefb-onegzznksa-m}}
{{#set: molecular-weight=180.166}}
+
{{#set: molecular-weight=223.205}}

Latest revision as of 11:11, 18 March 2021

Metabolite SINAPATE

  • common-name:
    • sinapate
  • smiles:
    • coc1(c=c(c=c(oc)c(o)=1)c=cc([o-])=o)
  • inchi-key:
    • pcmortlopmlefb-onegzznksa-m
  • molecular-weight:
    • 223.205

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality