Difference between revisions of "CPD-4581"

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(Created page with "Category:metabolite == Metabolite ITACONATE == * common-name: ** itaconate * smiles: ** c=c(c(=o)[o-])cc([o-])=o * inchi-key: ** lvhbhzanlowsrm-uhfffaoysa-l * molecular-we...")
(Created page with "Category:metabolite == Metabolite CPD-4127 == * common-name: ** isofucosterol * smiles: ** cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34)))) * inchi...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite ITACONATE ==
+
== Metabolite CPD-4127 ==
 
* common-name:
 
* common-name:
** itaconate
+
** isofucosterol
 
* smiles:
 
* smiles:
** c=c(c(=o)[o-])cc([o-])=o
+
** cc=c(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:
** lvhbhzanlowsrm-uhfffaoysa-l
+
** oselkochbmdkej-wgmizeqosa-n
 
* molecular-weight:
 
* molecular-weight:
** 128.084
+
** 412.698
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-8988]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-4210]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=itaconate}}
+
{{#set: common-name=isofucosterol}}
{{#set: inchi-key=inchikey=lvhbhzanlowsrm-uhfffaoysa-l}}
+
{{#set: inchi-key=inchikey=oselkochbmdkej-wgmizeqosa-n}}
{{#set: molecular-weight=128.084}}
+
{{#set: molecular-weight=412.698}}

Revision as of 11:16, 15 January 2021

Metabolite CPD-4127

  • common-name:
    • isofucosterol
  • smiles:
    • cc=c(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:
    • oselkochbmdkej-wgmizeqosa-n
  • molecular-weight:
    • 412.698

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality