Difference between revisions of "CPD-18539"

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(Created page with "Category:metabolite == Metabolite CPD0-2108 == * common-name: ** (2e)-oct-2-enoyl-coa * smiles: ** cccccc=cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op([o-])(=o)occ1(c(op...")
(Created page with "Category:metabolite == Metabolite CPD-2751 == * common-name: ** 5'-hydroxycotinine * smiles: ** c1(=o)(ccc(o)(n(c)1)c2(=cn=cc=c2)) * inchi-key: ** bbnhnzgtkswihd-snvbaglbs...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD0-2108 ==
+
== Metabolite CPD-2751 ==
 
* common-name:
 
* common-name:
** (2e)-oct-2-enoyl-coa
+
** 5'-hydroxycotinine
 
* smiles:
 
* smiles:
** cccccc=cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op([o-])(=o)occ1(c(op(=o)([o-])[o-])c(o)c(o1)n3(c=nc2(c(n)=nc=nc=23))))=o
+
** c1(=o)(ccc(o)(n(c)1)c2(=cn=cc=c2))
 
* inchi-key:
 
* inchi-key:
** cpsdnaxxkwvyiy-ntlmcjqisa-j
+
** bbnhnzgtkswihd-snvbaglbsa-n
 
* molecular-weight:
 
* molecular-weight:
** 887.685
+
** 192.217
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-14229]]
 
* [[RXN-14276]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[ACOA80OR]]
+
* [[RXN66-163]]
* [[RXN-12669]]
 
* [[RXN-14229]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=(2e)-oct-2-enoyl-coa}}
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{{#set: common-name=5'-hydroxycotinine}}
{{#set: inchi-key=inchikey=cpsdnaxxkwvyiy-ntlmcjqisa-j}}
+
{{#set: inchi-key=inchikey=bbnhnzgtkswihd-snvbaglbsa-n}}
{{#set: molecular-weight=887.685}}
+
{{#set: molecular-weight=192.217}}

Revision as of 08:25, 15 March 2021

Metabolite CPD-2751

  • common-name:
    • 5'-hydroxycotinine
  • smiles:
    • c1(=o)(ccc(o)(n(c)1)c2(=cn=cc=c2))
  • inchi-key:
    • bbnhnzgtkswihd-snvbaglbsa-n
  • molecular-weight:
    • 192.217

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality