Difference between revisions of "ACP"

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(Created page with "Category:metabolite == Metabolite CPD-18550 == * common-name: ** quinoxaline-2-carboxyl adenylate * smiles: ** c(c3(c(c(c(n2(c1(=c(c(=nc=n1)n)n=c2)))o3)o)o))op(oc(=o)c4(c=...")
(Created page with "Category:metabolite == Metabolite ANDROST4ENE == * common-name: ** androst-4-ene-3,17-dione * smiles: ** cc34(ccc(=o)c=c(cc[ch]1([ch](ccc2(c)(c(cc[ch]12)=o))3))4) * inchi-...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-18550 ==
+
== Metabolite ANDROST4ENE ==
 
* common-name:
 
* common-name:
** quinoxaline-2-carboxyl adenylate
+
** androst-4-ene-3,17-dione
 
* smiles:
 
* smiles:
** c(c3(c(c(c(n2(c1(=c(c(=nc=n1)n)n=c2)))o3)o)o))op(oc(=o)c4(c=nc5(=cc=cc=c(n=4)5)))([o-])=o
+
** cc34(ccc(=o)c=c(cc[ch]1([ch](ccc2(c)(c(cc[ch]12)=o))3))4)
 
* inchi-key:
 
* inchi-key:
** vmjweicpcdrxql-scfuhwhpsa-m
+
** aemfnilzojdqlw-qaggrknesa-n
 
* molecular-weight:
 
* molecular-weight:
** 502.359
+
** 286.413
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-17155]]
+
* [[1.1.1.64-RXN]]
 +
* [[TESTOSTERONE-17-BETA-DEHYDROGENASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[1.1.1.51-RXN]]
 +
* [[RXN-12124]]
 +
* [[TESTOSTERONE-17-BETA-DEHYDROGENASE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=quinoxaline-2-carboxyl adenylate}}
+
{{#set: common-name=androst-4-ene-3,17-dione}}
{{#set: inchi-key=inchikey=vmjweicpcdrxql-scfuhwhpsa-m}}
+
{{#set: inchi-key=inchikey=aemfnilzojdqlw-qaggrknesa-n}}
{{#set: molecular-weight=502.359}}
+
{{#set: molecular-weight=286.413}}

Revision as of 11:15, 15 January 2021

Metabolite ANDROST4ENE

  • common-name:
    • androst-4-ene-3,17-dione
  • smiles:
    • cc34(ccc(=o)c=c(cc[ch]1([ch](ccc2(c)(c(cc[ch]12)=o))3))4)
  • inchi-key:
    • aemfnilzojdqlw-qaggrknesa-n
  • molecular-weight:
    • 286.413

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality