Difference between revisions of "CPDMETA-13652"

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(Created page with "Category:metabolite == Metabolite ISOVALERYL-COA == * common-name: ** isovaleryl-coa * smiles: ** cc(cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o...")
(Created page with "Category:metabolite == Metabolite CPDMETA-13652 == * common-name: ** raucaffrinoline * smiles: ** cc3(n5(c2(c1(=nc6(=cc=cc=c(c41(c(c(c(c2)c(co)3)c(c4)5)oc(=o)c))6))))) * i...")
 
(3 intermediate revisions by 2 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite ISOVALERYL-COA ==
+
== Metabolite CPDMETA-13652 ==
 
* common-name:
 
* common-name:
** isovaleryl-coa
+
** raucaffrinoline
 
* smiles:
 
* smiles:
** cc(cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-])c
+
** cc3(n5(c2(c1(=nc6(=cc=cc=c(c41(c(c(c(c2)c(co)3)c(c4)5)oc(=o)c))6)))))
 
* inchi-key:
 
* inchi-key:
** uyvziwwbjmyrcd-zmhdxicwsa-j
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** ximpcxfldskalh-vqhwpedhsa-n
 
* molecular-weight:
 
* molecular-weight:
** 847.62
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** 352.432
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[ISOVALERYLCOA-DHLIPOAMIDE-RXN]]
 
* [[IVCDH]]
 
* [[RXN-14264]]
 
* [[RXN0-2301]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-14264]]
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* [[RXN-12673]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=isovaleryl-coa}}
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{{#set: common-name=raucaffrinoline}}
{{#set: inchi-key=inchikey=uyvziwwbjmyrcd-zmhdxicwsa-j}}
+
{{#set: inchi-key=inchikey=ximpcxfldskalh-vqhwpedhsa-n}}
{{#set: molecular-weight=847.62}}
+
{{#set: molecular-weight=352.432}}

Latest revision as of 11:14, 18 March 2021

Metabolite CPDMETA-13652

  • common-name:
    • raucaffrinoline
  • smiles:
    • cc3(n5(c2(c1(=nc6(=cc=cc=c(c41(c(c(c(c2)c(co)3)c(c4)5)oc(=o)c))6)))))
  • inchi-key:
    • ximpcxfldskalh-vqhwpedhsa-n
  • molecular-weight:
    • 352.432

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality