Difference between revisions of "CPD-18390"

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(Created page with "Category:metabolite == Metabolite EPISTEROL == * common-name: ** episterol * smiles: ** cc(c)c(=c)ccc(c)[ch]3(cc[ch]4(c2(=cc[ch]1(cc(o)ccc(c)1c2ccc(c)34)))) * inchi-key: *...")
(Created page with "Category:metabolite == Metabolite CPD-8621 == * common-name: ** zymostenol * smiles: ** cc(c)cccc([ch]4(c1(c)([ch](c2(=c(cc1)c3(c)([ch](cc2)cc(o)cc3)))cc4)))c * inchi-key:...")
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite EPISTEROL ==
+
== Metabolite CPD-8621 ==
 
* common-name:
 
* common-name:
** episterol
+
** zymostenol
 
* smiles:
 
* smiles:
** cc(c)c(=c)ccc(c)[ch]3(cc[ch]4(c2(=cc[ch]1(cc(o)ccc(c)1c2ccc(c)34))))
+
** cc(c)cccc([ch]4(c1(c)([ch](c2(=c(cc1)c3(c)([ch](cc2)cc(o)cc3)))cc4)))c
 
* inchi-key:
 
* inchi-key:
** btcaeoldeypgge-lpwclqgbsa-n
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** qetlkndkqoxzrp-xtgbijofsa-n
 
* molecular-weight:
 
* molecular-weight:
** 398.671
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** 386.66
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-4181-CPD-4101/DIMETHYL-GLYCINE//EPISTEROL/BETAINE.45.]]
 
* [[RXN3O-218]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-4181-CPD-4101/DIMETHYL-GLYCINE//EPISTEROL/BETAINE.45.]]
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* [[RXN66-24]]
* [[RXN3O-203]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=episterol}}
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{{#set: common-name=zymostenol}}
{{#set: inchi-key=inchikey=btcaeoldeypgge-lpwclqgbsa-n}}
+
{{#set: inchi-key=inchikey=qetlkndkqoxzrp-xtgbijofsa-n}}
{{#set: molecular-weight=398.671}}
+
{{#set: molecular-weight=386.66}}

Revision as of 08:25, 15 March 2021

Metabolite CPD-8621

  • common-name:
    • zymostenol
  • smiles:
    • cc(c)cccc([ch]4(c1(c)([ch](c2(=c(cc1)c3(c)([ch](cc2)cc(o)cc3)))cc4)))c
  • inchi-key:
    • qetlkndkqoxzrp-xtgbijofsa-n
  • molecular-weight:
    • 386.66

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality