Difference between revisions of "CPD-11401"

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(Created page with "Category:metabolite == Metabolite CPD-11401 == * common-name: ** l-thyroxine acyl β-d-glucuronide * smiles: ** c([o-])(=o)c1(oc(c(o)c(o)c(o)1)oc(=o)c(n)cc2(=cc(i)=c(c...")
(Created page with "Category:metabolite == Metabolite CPD-1803 == * common-name: ** n-acetyl-7-o-acetylneuraminate * smiles: ** cc(=o)nc1(c(cc(c(=o)[o-])(o)o[ch]1c(oc(c)=o)c(o)co)o) * inchi-k...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-11401 ==
+
== Metabolite CPD-1803 ==
 
* common-name:
 
* common-name:
** l-thyroxine acyl β-d-glucuronide
+
** n-acetyl-7-o-acetylneuraminate
 
* smiles:
 
* smiles:
** c([o-])(=o)c1(oc(c(o)c(o)c(o)1)oc(=o)c(n)cc2(=cc(i)=c(c(i)=c2)oc3(=cc(i)=c(o)c(i)=c3)))
+
** cc(=o)nc1(c(cc(c(=o)[o-])(o)o[ch]1c(oc(c)=o)c(o)co)o)
 
* inchi-key:
 
* inchi-key:
** hmtfxpjobpioin-dkbymcrtsa-m
+
** duokwmwkfgdudq-grrzbweesa-m
 
* molecular-weight:
 
* molecular-weight:
** 951.992
+
** 350.302
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[2.3.1.45-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-10608]]
+
* [[2.3.1.45-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=l-thyroxine acyl β-d-glucuronide}}
+
{{#set: common-name=n-acetyl-7-o-acetylneuraminate}}
{{#set: inchi-key=inchikey=hmtfxpjobpioin-dkbymcrtsa-m}}
+
{{#set: inchi-key=inchikey=duokwmwkfgdudq-grrzbweesa-m}}
{{#set: molecular-weight=951.992}}
+
{{#set: molecular-weight=350.302}}

Revision as of 14:55, 5 January 2021

Metabolite CPD-1803

  • common-name:
    • n-acetyl-7-o-acetylneuraminate
  • smiles:
    • cc(=o)nc1(c(cc(c(=o)[o-])(o)o[ch]1c(oc(c)=o)c(o)co)o)
  • inchi-key:
    • duokwmwkfgdudq-grrzbweesa-m
  • molecular-weight:
    • 350.302

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality