Difference between revisions of "CPD0-2030"

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(Created page with "Category:metabolite == Metabolite CPD-2750 == * common-name: ** trans-3'-hydroxycotinine * smiles: ** c1(=o)(c(o)c[ch](n(c)1)c2(c=nc=cc=2)) * inchi-key: ** xokcjxzznauiqn-...")
(Created page with "Category:metabolite == Metabolite CPD-15104 == * common-name: ** (r)-3-hydroxy-3-methyl-2-oxopentanoate * smiles: ** ccc(o)(c)c(=o)c(=o)[o-] * inchi-key: ** yjvowrawfxresp...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-2750 ==
+
== Metabolite CPD-15104 ==
 
* common-name:
 
* common-name:
** trans-3'-hydroxycotinine
+
** (r)-3-hydroxy-3-methyl-2-oxopentanoate
 
* smiles:
 
* smiles:
** c1(=o)(c(o)c[ch](n(c)1)c2(c=nc=cc=2))
+
** ccc(o)(c)c(=o)c(=o)[o-]
 
* inchi-key:
 
* inchi-key:
** xokcjxzznauiqn-dtwkunhwsa-n
+
** yjvowrawfxresp-zcfiwibfsa-m
 
* molecular-weight:
 
* molecular-weight:
** 192.217
+
** 145.135
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN66-162]]
+
* [[KARI_LPAREN_23dhmp_RPAREN_]]
 +
* [[RXN-14106]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN66-161]]
+
* [[RXN-14106]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=trans-3'-hydroxycotinine}}
+
{{#set: common-name=(r)-3-hydroxy-3-methyl-2-oxopentanoate}}
{{#set: inchi-key=inchikey=xokcjxzznauiqn-dtwkunhwsa-n}}
+
{{#set: inchi-key=inchikey=yjvowrawfxresp-zcfiwibfsa-m}}
{{#set: molecular-weight=192.217}}
+
{{#set: molecular-weight=145.135}}

Revision as of 15:27, 5 January 2021

Metabolite CPD-15104

  • common-name:
    • (r)-3-hydroxy-3-methyl-2-oxopentanoate
  • smiles:
    • ccc(o)(c)c(=o)c(=o)[o-]
  • inchi-key:
    • yjvowrawfxresp-zcfiwibfsa-m
  • molecular-weight:
    • 145.135

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality