Difference between revisions of "ITP"

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(Created page with "Category:metabolite == Metabolite CPD-7524 == * common-name: ** 7,9,9'-cis-neurosporene * smiles: ** cc(=cccc(=cc=cc(c)=cc=cc(=cc=cc=c(c=cc=c(c)ccc=c(ccc=c(c)c)c)c)c)c)c *...")
(Created page with "Category:metabolite == Metabolite CPD-11409 == * common-name: ** tetraiodothyroacetate ether glucuronide * smiles: ** c(=o)([o-])cc1(c=c(i)c(=c(i)c=1)oc3(=cc(i)=c(oc2(oc(c...")
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-7524 ==
+
== Metabolite CPD-11409 ==
 
* common-name:
 
* common-name:
** 7,9,9'-cis-neurosporene
+
** tetraiodothyroacetate ether glucuronide
 
* smiles:
 
* smiles:
** cc(=cccc(=cc=cc(c)=cc=cc(=cc=cc=c(c=cc=c(c)ccc=c(ccc=c(c)c)c)c)c)c)c
+
** c(=o)([o-])cc1(c=c(i)c(=c(i)c=1)oc3(=cc(i)=c(oc2(oc(c([o-])=o)c(o)c(o)c(o)2))c(i)=c3))
 
* inchi-key:
 
* inchi-key:
** atcicvfrsjqydv-ifjqppewsa-n
+
** gyorpzqlvmnogy-rupwjetcsa-l
 
* molecular-weight:
 
* molecular-weight:
** 538.898
+
** 921.943
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-11357]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-11356]]
+
* [[RXN-10616]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=7,9,9'-cis-neurosporene}}
+
{{#set: common-name=tetraiodothyroacetate ether glucuronide}}
{{#set: inchi-key=inchikey=atcicvfrsjqydv-ifjqppewsa-n}}
+
{{#set: inchi-key=inchikey=gyorpzqlvmnogy-rupwjetcsa-l}}
{{#set: molecular-weight=538.898}}
+
{{#set: molecular-weight=921.943}}

Revision as of 15:25, 5 January 2021

Metabolite CPD-11409

  • common-name:
    • tetraiodothyroacetate ether glucuronide
  • smiles:
    • c(=o)([o-])cc1(c=c(i)c(=c(i)c=1)oc3(=cc(i)=c(oc2(oc(c([o-])=o)c(o)c(o)c(o)2))c(i)=c3))
  • inchi-key:
    • gyorpzqlvmnogy-rupwjetcsa-l
  • molecular-weight:
    • 921.943

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality