Difference between revisions of "CPD-19071"

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(Created page with "Category:metabolite == Metabolite CPD-367 == * common-name: ** (2r)-3-sulfolactate * smiles: ** c(=o)([o-])c(o)cs([o-])(=o)=o * inchi-key: ** cqqgiwjsicouon-reohclbhsa-l *...")
(Created page with "Category:metabolite == Metabolite CPD-19071 == * common-name: ** (25s)-26-oxocholesterol * smiles: ** cc([ch]=o)cccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34)...")
 
(One intermediate revision by one other user not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-367 ==
+
== Metabolite CPD-19071 ==
 
* common-name:
 
* common-name:
** (2r)-3-sulfolactate
+
** (25s)-26-oxocholesterol
 
* smiles:
 
* smiles:
** c(=o)([o-])c(o)cs([o-])(=o)=o
+
** cc([ch]=o)cccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34))))
 
* inchi-key:
 
* inchi-key:
** cqqgiwjsicouon-reohclbhsa-l
+
** jugxqejpwdyojv-vicxtrefsa-n
 
* molecular-weight:
 
* molecular-weight:
** 168.121
+
** 400.643
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[R230-RXN]]
+
* [[RXN-17654]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[R230-RXN]]
+
* [[RXN-17653]]
* [[RXN-11727]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=(2r)-3-sulfolactate}}
+
{{#set: common-name=(25s)-26-oxocholesterol}}
{{#set: inchi-key=inchikey=cqqgiwjsicouon-reohclbhsa-l}}
+
{{#set: inchi-key=inchikey=jugxqejpwdyojv-vicxtrefsa-n}}
{{#set: molecular-weight=168.121}}
+
{{#set: molecular-weight=400.643}}

Latest revision as of 11:13, 18 March 2021

Metabolite CPD-19071

  • common-name:
    • (25s)-26-oxocholesterol
  • smiles:
    • cc([ch]=o)cccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34))))
  • inchi-key:
    • jugxqejpwdyojv-vicxtrefsa-n
  • molecular-weight:
    • 400.643

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality