Difference between revisions of "SJ05454"

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(Created page with "Category:metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4124 CPD-4124] == * common-name: ** 24-ethylidenelophenol * smiles: ** cc=c(c(c)c)ccc(c)[ch...")
 
(Created page with "Category:metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PRENAL PRENAL] == * common-name: ** 3-methyl-2-butenal * smiles: ** cc(=c[ch]=o)c * inchi-key:...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4124 CPD-4124] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PRENAL PRENAL] ==
 
* common-name:
 
* common-name:
** 24-ethylidenelophenol
+
** 3-methyl-2-butenal
 
* smiles:
 
* smiles:
** cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4(c2(=cc[ch]1(c(c)c(o)ccc(c)1[ch]2ccc(c)34))))
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** cc(=c[ch]=o)c
 
* inchi-key:
 
* inchi-key:
** lpzccmiisibrei-jxmpmkkesa-n
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** sepqtyodoklvsb-uhfffaoysa-n
 
* molecular-weight:
 
* molecular-weight:
** 426.724
+
** 84.118
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-4208-CPD-4124/DIMETHYL-GLYCINE//CPD-4125/BETAINE.44.]]
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* [[1.5.99.12-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[2.1.1.143-RXN]]
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* [[1.5.99.12-RXN]]
* [[RXN-4208-CPD-4124/DIMETHYL-GLYCINE//CPD-4125/BETAINE.44.]]
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* [[1.8.3.5-RXN]]
 +
* [[RXN-11989]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=24-ethylidenelophenol}}
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{{#set: common-name=3-methyl-2-butenal}}
{{#set: inchi-key=inchikey=lpzccmiisibrei-jxmpmkkesa-n}}
+
{{#set: inchi-key=inchikey=sepqtyodoklvsb-uhfffaoysa-n}}
{{#set: molecular-weight=426.724}}
+
{{#set: molecular-weight=84.118}}

Revision as of 14:20, 26 August 2019

Metabolite PRENAL

  • common-name:
    • 3-methyl-2-butenal
  • smiles:
    • cc(=c[ch]=o)c
  • inchi-key:
    • sepqtyodoklvsb-uhfffaoysa-n
  • molecular-weight:
    • 84.118

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality