Difference between revisions of "CPD-6442"

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(Created page with "Category:metabolite == Metabolite CPD-13793 == * common-name: ** 3-oxo-24-ethyl-cholest-5-ene * smiles: ** ccc(c(c)c)ccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(=o)ccc(c)1[ch]2ccc(...")
(Created page with "Category:metabolite == Metabolite CPD-6442 == * common-name: ** methylsalicylate * smiles: ** coc(c1(c=cc=cc=1o))=o * inchi-key: ** oswpmrlsedhdff-uhfffaoysa-n * molecular...")
 
(6 intermediate revisions by 3 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-13793 ==
+
== Metabolite CPD-6442 ==
 
* common-name:
 
* common-name:
** 3-oxo-24-ethyl-cholest-5-ene
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** methylsalicylate
 
* smiles:
 
* smiles:
** ccc(c(c)c)ccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(=o)ccc(c)1[ch]2ccc(c)34))))
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** coc(c1(c=cc=cc=1o))=o
 
* inchi-key:
 
* inchi-key:
** kyofijxmvnqyfc-xjzkhkohsa-n
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** oswpmrlsedhdff-uhfffaoysa-n
 
* molecular-weight:
 
* molecular-weight:
** 412.698
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** 152.149
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-12789]]
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* [[RXNQT-4366]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-12789]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3-oxo-24-ethyl-cholest-5-ene}}
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{{#set: common-name=methylsalicylate}}
{{#set: inchi-key=inchikey=kyofijxmvnqyfc-xjzkhkohsa-n}}
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{{#set: inchi-key=inchikey=oswpmrlsedhdff-uhfffaoysa-n}}
{{#set: molecular-weight=412.698}}
+
{{#set: molecular-weight=152.149}}

Latest revision as of 11:16, 18 March 2021

Metabolite CPD-6442

  • common-name:
    • methylsalicylate
  • smiles:
    • coc(c1(c=cc=cc=1o))=o
  • inchi-key:
    • oswpmrlsedhdff-uhfffaoysa-n
  • molecular-weight:
    • 152.149

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality