Difference between revisions of "SJ04983"

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(Created page with "Category:metabolite == Metabolite 17-BETA-HYDROXY-5ALPHA-ANDROSTAN-3-O == * common-name: ** 17-β-hydroxy-5-α-androstan-3-one * smiles: ** cc34([ch]2([ch]([ch]1(...")
(Created page with "Category:metabolite == Metabolite CPD0-2472 == * common-name: ** (r)-nadhx * smiles: ** c1(=c(ccc(o)n1c5(oc(cop(=o)([o-])op(=o)([o-])occ2(oc(c(o)c(o)2)n4(c=nc3(c(n)=nc=nc=...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite 17-BETA-HYDROXY-5ALPHA-ANDROSTAN-3-O ==
+
== Metabolite CPD0-2472 ==
 
* common-name:
 
* common-name:
** 17-β-hydroxy-5-α-androstan-3-one
+
** (r)-nadhx
 
* smiles:
 
* smiles:
** cc34([ch]2([ch]([ch]1(c(c)(c(o)cc1)cc2))cc[ch]3cc(=o)cc4))
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** c1(=c(ccc(o)n1c5(oc(cop(=o)([o-])op(=o)([o-])occ2(oc(c(o)c(o)2)n4(c=nc3(c(n)=nc=nc=34))))c(o)c(o)5))c(n)=o)
 
* inchi-key:
 
* inchi-key:
** nvkawkqgwwiwpm-abevxsgrsa-n
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** idbzkgqrlbfufq-mtkbybfrsa-l
 
* molecular-weight:
 
* molecular-weight:
** 290.445
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** 681.445
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-12752]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN66-343]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=17-β-hydroxy-5-α-androstan-3-one}}
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{{#set: common-name=(r)-nadhx}}
{{#set: inchi-key=inchikey=nvkawkqgwwiwpm-abevxsgrsa-n}}
+
{{#set: inchi-key=inchikey=idbzkgqrlbfufq-mtkbybfrsa-l}}
{{#set: molecular-weight=290.445}}
+
{{#set: molecular-weight=681.445}}

Revision as of 18:52, 14 January 2021

Metabolite CPD0-2472

  • common-name:
    • (r)-nadhx
  • smiles:
    • c1(=c(ccc(o)n1c5(oc(cop(=o)([o-])op(=o)([o-])occ2(oc(c(o)c(o)2)n4(c=nc3(c(n)=nc=nc=34))))c(o)c(o)5))c(n)=o)
  • inchi-key:
    • idbzkgqrlbfufq-mtkbybfrsa-l
  • molecular-weight:
    • 681.445

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality