Difference between revisions of "CPD-13670"

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(Created page with "Category:metabolite == Metabolite CPD-578 == * common-name: ** urea-1-carboxylate * smiles: ** c(n)(nc([o-])=o)=o * inchi-key: ** avwrkzwqtyikiy-uhfffaoysa-m * molecular-w...")
(Created page with "Category:metabolite == Metabolite CPD-13670 == * common-name: ** 30-hydroxy-11-oxo-β-amyrin * smiles: ** cc1(c(ccc2(c3(c(ccc12)(c4(c(=cc(=o)3)c5(c(cc4)(ccc(c5)(co)c)c...")
 
(6 intermediate revisions by 3 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-578 ==
+
== Metabolite CPD-13670 ==
 
* common-name:
 
* common-name:
** urea-1-carboxylate
+
** 30-hydroxy-11-oxo-β-amyrin
 
* smiles:
 
* smiles:
** c(n)(nc([o-])=o)=o
+
** cc1(c(ccc2(c3(c(ccc12)(c4(c(=cc(=o)3)c5(c(cc4)(ccc(c5)(co)c)c))c)c))c)o)c
 
* inchi-key:
 
* inchi-key:
** avwrkzwqtyikiy-uhfffaoysa-m
+
** jcgxiyqlryphdg-zbyjljtqsa-n
 
* molecular-weight:
 
* molecular-weight:
** 103.057
+
** 456.707
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[ALLOPHANATE-HYDROLASE-RXN]]
+
* [[RXN-13493]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-13492]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=urea-1-carboxylate}}
+
{{#set: common-name=30-hydroxy-11-oxo-β-amyrin}}
{{#set: inchi-key=inchikey=avwrkzwqtyikiy-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=jcgxiyqlryphdg-zbyjljtqsa-n}}
{{#set: molecular-weight=103.057}}
+
{{#set: molecular-weight=456.707}}

Latest revision as of 11:11, 18 March 2021

Metabolite CPD-13670

  • common-name:
    • 30-hydroxy-11-oxo-β-amyrin
  • smiles:
    • cc1(c(ccc2(c3(c(ccc12)(c4(c(=cc(=o)3)c5(c(cc4)(ccc(c5)(co)c)c))c)c))c)o)c
  • inchi-key:
    • jcgxiyqlryphdg-zbyjljtqsa-n
  • molecular-weight:
    • 456.707

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality