Difference between revisions of "CPD-11412"

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(Created page with "Category:metabolite == Metabolite ALLYSINE == * common-name: ** (s)-2-amino-6-oxohexanoate * smiles: ** [ch](=o)cccc([n+])c(=o)[o-] * inchi-key: ** gfxytqpnnxgict-yfkpbyrv...")
(Created page with "Category:metabolite == Metabolite CPD-11412 == * common-name: ** triiodothyroacetate ester glucuronide * smiles: ** c(oc1(c(o)c(o)c(o)c(c(=o)[o-])o1))(=o)cc2(c=c(i)c(=c(i)...")
 
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite ALLYSINE ==
+
== Metabolite CPD-11412 ==
 
* common-name:
 
* common-name:
** (s)-2-amino-6-oxohexanoate
+
** triiodothyroacetate ester glucuronide
 
* smiles:
 
* smiles:
** [ch](=o)cccc([n+])c(=o)[o-]
+
** c(oc1(c(o)c(o)c(o)c(c(=o)[o-])o1))(=o)cc2(c=c(i)c(=c(i)c=2)oc3(=cc(i)=c(o)c=c3))
 
* inchi-key:
 
* inchi-key:
** gfxytqpnnxgict-yfkpbyrvsa-n
+
** fpejnmnxcsitjo-kfyubchvsa-m
 
* molecular-weight:
 
* molecular-weight:
** 145.158
+
** 797.054
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[1.5.1.9-RXN]]
+
* [[RXN-10618]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=(s)-2-amino-6-oxohexanoate}}
+
{{#set: common-name=triiodothyroacetate ester glucuronide}}
{{#set: inchi-key=inchikey=gfxytqpnnxgict-yfkpbyrvsa-n}}
+
{{#set: inchi-key=inchikey=fpejnmnxcsitjo-kfyubchvsa-m}}
{{#set: molecular-weight=145.158}}
+
{{#set: molecular-weight=797.054}}

Latest revision as of 11:12, 18 March 2021

Metabolite CPD-11412

  • common-name:
    • triiodothyroacetate ester glucuronide
  • smiles:
    • c(oc1(c(o)c(o)c(o)c(c(=o)[o-])o1))(=o)cc2(c=c(i)c(=c(i)c=2)oc3(=cc(i)=c(o)c=c3))
  • inchi-key:
    • fpejnmnxcsitjo-kfyubchvsa-m
  • molecular-weight:
    • 797.054

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality