Difference between revisions of "CPD-10576"

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(Created page with "Category:metabolite == Metabolite CPD-4124 == * common-name: ** 24-ethylidenelophenol * smiles: ** cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4(c2(=cc[ch]1(c(c)c(o)ccc(c)1[ch]2ccc(c)34)...")
(Created page with "Category:metabolite == Metabolite CPD-10576 == * common-name: ** 4-chlorosalicylate * smiles: ** c(c1(c=cc(cl)=cc=1o))([o-])=o * inchi-key: ** lwxfczxrfbuoor-uhfffaoysa-m...")
 
(5 intermediate revisions by 2 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-4124 ==
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== Metabolite CPD-10576 ==
 
* common-name:
 
* common-name:
** 24-ethylidenelophenol
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** 4-chlorosalicylate
 
* smiles:
 
* smiles:
** cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4(c2(=cc[ch]1(c(c)c(o)ccc(c)1[ch]2ccc(c)34))))
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** c(c1(c=cc(cl)=cc=1o))([o-])=o
 
* inchi-key:
 
* inchi-key:
** lpzccmiisibrei-jxmpmkkesa-n
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** lwxfczxrfbuoor-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 426.724
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** 171.56
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-4208-CPD-4124/DIMETHYL-GLYCINE//CPD-4125/BETAINE.44.]]
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* [[RXN-9912]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[2.1.1.143-RXN]]
 
* [[RXN-4208-CPD-4124/DIMETHYL-GLYCINE//CPD-4125/BETAINE.44.]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=24-ethylidenelophenol}}
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{{#set: common-name=4-chlorosalicylate}}
{{#set: inchi-key=inchikey=lpzccmiisibrei-jxmpmkkesa-n}}
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{{#set: inchi-key=inchikey=lwxfczxrfbuoor-uhfffaoysa-m}}
{{#set: molecular-weight=426.724}}
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{{#set: molecular-weight=171.56}}

Latest revision as of 11:12, 18 March 2021

Metabolite CPD-10576

  • common-name:
    • 4-chlorosalicylate
  • smiles:
    • c(c1(c=cc(cl)=cc=1o))([o-])=o
  • inchi-key:
    • lwxfczxrfbuoor-uhfffaoysa-m
  • molecular-weight:
    • 171.56

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality