Difference between revisions of "CPD-11398"

From metabolic_network
Jump to navigation Jump to search
(Created page with "Category:metabolite == Metabolite CPD-19488 == * common-name: ** 3-isopropyl-9-(methylthio)-2-oxononanoate * smiles: ** csccccccc(c(=o)c(=o)[o-])c(=o)[o-] * inchi-key: **...")
(Created page with "Category:metabolite == Metabolite CPD-11398 == * common-name: ** l-thyroxine phenolic β-d-glucuronide * smiles: ** c(=o)([o-])c([n+])cc1(=cc(i)=c(c(i)=c1)oc3(c=c(i)c(...")
 
(5 intermediate revisions by 3 users not shown)
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-19488 ==
+
== Metabolite CPD-11398 ==
 
* common-name:
 
* common-name:
** 3-isopropyl-9-(methylthio)-2-oxononanoate
+
** l-thyroxine phenolic β-d-glucuronide
 
* smiles:
 
* smiles:
** csccccccc(c(=o)c(=o)[o-])c(=o)[o-]
+
** c(=o)([o-])c([n+])cc1(=cc(i)=c(c(i)=c1)oc3(c=c(i)c(oc2(oc(c(=o)[o-])c(o)c(o)c(o)2))=c(i)c=3))
 
* inchi-key:
 
* inchi-key:
** pbyokogrhhzthq-uhfffaoysa-l
+
** rghrjbikiyuhev-sgpdefqssa-m
 
* molecular-weight:
 
* molecular-weight:
** 260.304
+
** 951.992
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-18202]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-18202]]
+
* [[RXN-10606]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3-isopropyl-9-(methylthio)-2-oxononanoate}}
+
{{#set: common-name=l-thyroxine phenolic β-d-glucuronide}}
{{#set: inchi-key=inchikey=pbyokogrhhzthq-uhfffaoysa-l}}
+
{{#set: inchi-key=inchikey=rghrjbikiyuhev-sgpdefqssa-m}}
{{#set: molecular-weight=260.304}}
+
{{#set: molecular-weight=951.992}}

Latest revision as of 11:14, 18 March 2021

Metabolite CPD-11398

  • common-name:
    • l-thyroxine phenolic β-d-glucuronide
  • smiles:
    • c(=o)([o-])c([n+])cc1(=cc(i)=c(c(i)=c1)oc3(c=c(i)c(oc2(oc(c(=o)[o-])c(o)c(o)c(o)2))=c(i)c=3))
  • inchi-key:
    • rghrjbikiyuhev-sgpdefqssa-m
  • molecular-weight:
    • 951.992

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality