Difference between revisions of "CPD-17313"

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(Created page with "Category:metabolite == Metabolite 2-KETO-3-METHYL-VALERATE == * common-name: ** (s)-3-methyl-2-oxopentanoate * smiles: ** ccc(c)c(=o)c([o-])=o * inchi-key: ** jvqyswduaoah...")
(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 2-KETO-3-METHYL-VALERATE ==
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== Metabolite CPD-15104 ==
 
* common-name:
 
* common-name:
** (s)-3-methyl-2-oxopentanoate
+
** (r)-3-hydroxy-3-methyl-2-oxopentanoate
 
* smiles:
 
* smiles:
** ccc(c)c(=o)c([o-])=o
+
** ccc(o)(c)c(=o)c(=o)[o-]
 
* inchi-key:
 
* inchi-key:
** jvqyswduaoahfm-bypyzucnsa-m
+
** yjvowrawfxresp-zcfiwibfsa-m
 
* molecular-weight:
 
* molecular-weight:
** 129.135
+
** 145.135
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[2KETO-3METHYLVALERATE-RXN]]
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* [[KARI_LPAREN_23dhmp_RPAREN_]]
* [[BRANCHED-CHAINAMINOTRANSFERILEU-RXN]]
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* [[RXN-14106]]
* [[METHYLVALERATE-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[2KETO-3METHYLVALERATE-RXN]]
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* [[RXN-14106]]
* [[BRANCHED-CHAINAMINOTRANSFERILEU-RXN]]
 
* [[DIHYDROXYMETVALDEHYDRAT-RXN]]
 
* [[METHYLVALERATE-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=(s)-3-methyl-2-oxopentanoate}}
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{{#set: common-name=(r)-3-hydroxy-3-methyl-2-oxopentanoate}}
{{#set: inchi-key=inchikey=jvqyswduaoahfm-bypyzucnsa-m}}
+
{{#set: inchi-key=inchikey=yjvowrawfxresp-zcfiwibfsa-m}}
{{#set: molecular-weight=129.135}}
+
{{#set: molecular-weight=145.135}}

Revision as of 13:09, 14 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