Difference between revisions of "CPD1F-437"

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(Created page with "Category:metabolite == Metabolite CPD-13122 == * common-name: ** 4-deoxy-l-threo-hex-4-enopyranuronate * smiles: ** c(c1(oc(c(c(c=1)o)o)o))([o-])=o * inchi-key: ** iakkjsv...")
(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(...")
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-13122 ==
+
== Metabolite CPD-13793 ==
 
* common-name:
 
* common-name:
** 4-deoxy-l-threo-hex-4-enopyranuronate
+
** 3-oxo-24-ethyl-cholest-5-ene
 
* smiles:
 
* smiles:
** c(c1(oc(c(c(c=1)o)o)o))([o-])=o
+
** ccc(c(c)c)ccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(=o)ccc(c)1[ch]2ccc(c)34))))
 
* inchi-key:
 
* inchi-key:
** iakkjsvsfctlry-baktxgbysa-m
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** kyofijxmvnqyfc-xjzkhkohsa-n
 
* molecular-weight:
 
* molecular-weight:
** 175.118
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** 412.698
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-16512]]
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* [[RXN-12789]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-12177]]
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* [[RXN-12789]]
* [[RXN-12178]]
 
* [[RXN-12270]]
 
* [[RXN-16485]]
 
* [[RXN-16512]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=4-deoxy-l-threo-hex-4-enopyranuronate}}
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{{#set: common-name=3-oxo-24-ethyl-cholest-5-ene}}
{{#set: inchi-key=inchikey=iakkjsvsfctlry-baktxgbysa-m}}
+
{{#set: inchi-key=inchikey=kyofijxmvnqyfc-xjzkhkohsa-n}}
{{#set: molecular-weight=175.118}}
+
{{#set: molecular-weight=412.698}}

Revision as of 08:30, 15 March 2021

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(c)34))))
  • inchi-key:
    • kyofijxmvnqyfc-xjzkhkohsa-n
  • molecular-weight:
    • 412.698

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality