Difference between revisions of "CPD-13576"

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(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-...")
(Created page with "Category:metabolite == Metabolite CPD-13576 == * common-name: ** 2-(2-carboxy-4-methylthiazol-5-yl)ethyl phosphate * smiles: ** cc1(=c(ccop([o-])(=o)[o-])sc(c(=o)[o-])=n1)...")
 
(4 intermediate revisions by 3 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite ANDROST4ENE ==
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== Metabolite CPD-13576 ==
 
* common-name:
 
* common-name:
** androst-4-ene-3,17-dione
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** 2-(2-carboxy-4-methylthiazol-5-yl)ethyl phosphate
 
* smiles:
 
* smiles:
** cc34(ccc(=o)c=c(cc[ch]1([ch](ccc2(c)(c(cc[ch]12)=o))3))4)
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** cc1(=c(ccop([o-])(=o)[o-])sc(c(=o)[o-])=n1)
 
* inchi-key:
 
* inchi-key:
** aemfnilzojdqlw-qaggrknesa-n
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** xwecmahakfwynv-uhfffaoysa-k
 
* molecular-weight:
 
* molecular-weight:
** 286.413
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** 264.169
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[1.1.1.64-RXN]]
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* [[RXN-12610]]
* [[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=androst-4-ene-3,17-dione}}
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{{#set: common-name=2-(2-carboxy-4-methylthiazol-5-yl)ethyl phosphate}}
{{#set: inchi-key=inchikey=aemfnilzojdqlw-qaggrknesa-n}}
+
{{#set: inchi-key=inchikey=xwecmahakfwynv-uhfffaoysa-k}}
{{#set: molecular-weight=286.413}}
+
{{#set: molecular-weight=264.169}}

Latest revision as of 11:13, 18 March 2021

Metabolite CPD-13576

  • common-name:
    • 2-(2-carboxy-4-methylthiazol-5-yl)ethyl phosphate
  • smiles:
    • cc1(=c(ccop([o-])(=o)[o-])sc(c(=o)[o-])=n1)
  • inchi-key:
    • xwecmahakfwynv-uhfffaoysa-k
  • molecular-weight:
    • 264.169

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality