Difference between revisions of "CPD-7031"

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(Created page with "Category:metabolite == Metabolite NICOTINATE_NUCLEOTIDE == * common-name: ** β-nicotinate d-ribonucleotide * smiles: ** c(op([o-])(=o)[o-])c1(c(o)c(o)c(o1)[n+]2(c=cc=...")
(Created page with "Category:metabolite == Metabolite 3-7-DIMETHYLXANTHINE == * common-name: ** theobromine * smiles: ** cn2(c=nc1(=c(c(nc(n(c)1)=o)=o)2)) * inchi-key: ** yapqbxqyljrxsa-uhfff...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite NICOTINATE_NUCLEOTIDE ==
+
== Metabolite 3-7-DIMETHYLXANTHINE ==
 
* common-name:
 
* common-name:
** β-nicotinate d-ribonucleotide
+
** theobromine
 
* smiles:
 
* smiles:
** c(op([o-])(=o)[o-])c1(c(o)c(o)c(o1)[n+]2(c=cc=c(c(=o)[o-])c=2))
+
** cn2(c=nc1(=c(c(nc(n(c)1)=o)=o)2))
 
* inchi-key:
 
* inchi-key:
** jouiqrnqjgxqdc-zyuzmqfosa-l
+
** yapqbxqyljrxsa-uhfffaoysa-n
 
* molecular-weight:
 
* molecular-weight:
** 333.191
+
** 180.166
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[NICONUCADENYLYLTRAN-RXN]]
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* [[RXN-11519]]
* [[RXN-14227]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[NICOTINATEPRIBOSYLTRANS-RXN]]
 
* [[QUINOPRIBOTRANS-RXN]]
 
* [[RXN-8443]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=β-nicotinate d-ribonucleotide}}
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{{#set: common-name=theobromine}}
{{#set: inchi-key=inchikey=jouiqrnqjgxqdc-zyuzmqfosa-l}}
+
{{#set: inchi-key=inchikey=yapqbxqyljrxsa-uhfffaoysa-n}}
{{#set: molecular-weight=333.191}}
+
{{#set: molecular-weight=180.166}}

Revision as of 15:25, 5 January 2021

Metabolite 3-7-DIMETHYLXANTHINE

  • common-name:
    • theobromine
  • smiles:
    • cn2(c=nc1(=c(c(nc(n(c)1)=o)=o)2))
  • inchi-key:
    • yapqbxqyljrxsa-uhfffaoysa-n
  • molecular-weight:
    • 180.166

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality