Difference between revisions of "CPD-12175"

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(Created page with "Category:metabolite == Metabolite 3-BETA-HYDROXYANDROST-5-EN-17-ONE == * common-name: ** 3-β-hydroxyandrost-5-en-17-one * smiles: ** cc24(ccc(o)cc(=cc[ch]1([ch]3(ccc(...")
(Created page with "Category:metabolite == Metabolite CPD-12175 == * common-name: ** (s)-3-hydroxy-isobutanoate * smiles: ** cc(c([o-])=o)co * inchi-key: ** dbxbtmszeoqqdu-vkhmyheasa-m * mole...")
 
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite 3-BETA-HYDROXYANDROST-5-EN-17-ONE ==
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== Metabolite CPD-12175 ==
 
* common-name:
 
* common-name:
** 3-β-hydroxyandrost-5-en-17-one
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** (s)-3-hydroxy-isobutanoate
 
* smiles:
 
* smiles:
** cc24(ccc(o)cc(=cc[ch]1([ch]3(ccc(=o)c(cc[ch]12)(c)3)))4)
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** cc(c([o-])=o)co
 
* inchi-key:
 
* inchi-key:
** fmgsklzlmkygdp-usoajaoksa-n
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** dbxbtmszeoqqdu-vkhmyheasa-m
 
* molecular-weight:
 
* molecular-weight:
** 288.429
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** 103.097
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN66-342]]
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* [[3-HYDROXYISOBUTYRATE-DEHYDROGENASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN66-342]]
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* [[3-HYDROXYISOBUTYRYL-COA-HYDROLASE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3-β-hydroxyandrost-5-en-17-one}}
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{{#set: common-name=(s)-3-hydroxy-isobutanoate}}
{{#set: inchi-key=inchikey=fmgsklzlmkygdp-usoajaoksa-n}}
+
{{#set: inchi-key=inchikey=dbxbtmszeoqqdu-vkhmyheasa-m}}
{{#set: molecular-weight=288.429}}
+
{{#set: molecular-weight=103.097}}

Latest revision as of 11:15, 18 March 2021

Metabolite CPD-12175

  • common-name:
    • (s)-3-hydroxy-isobutanoate
  • smiles:
    • cc(c([o-])=o)co
  • inchi-key:
    • dbxbtmszeoqqdu-vkhmyheasa-m
  • molecular-weight:
    • 103.097

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality