Difference between revisions of "CPD1F-120"

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(Created page with "Category:metabolite == Metabolite CPD-352 == * common-name: ** 17β-estradiol * smiles: ** cc12([ch](ccc(o)1)[ch]4([ch](cc2)c3(c(=cc(o)=cc=3)cc4))) * inchi-key: ** vox...")
(Created page with "Category:metabolite == Metabolite 3-DEHYDRO-SHIKIMATE == * common-name: ** 3-dehydroshikimate * smiles: ** c([o-])(=o)c1(=cc(=o)c(o)c(o)c1) * inchi-key: ** slwwjzmphjjoph-...")
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-352 ==
+
== Metabolite 3-DEHYDRO-SHIKIMATE ==
 
* common-name:
 
* common-name:
** 17β-estradiol
+
** 3-dehydroshikimate
 
* smiles:
 
* smiles:
** cc12([ch](ccc(o)1)[ch]4([ch](cc2)c3(c(=cc(o)=cc=3)cc4)))
+
** c([o-])(=o)c1(=cc(=o)c(o)c(o)c1)
 
* inchi-key:
 
* inchi-key:
** voxzdwnpvjitmn-zbrfxrbcsa-n
+
** slwwjzmphjjoph-phdidxhhsa-m
 
* molecular-weight:
 
* molecular-weight:
** 272.386
+
** 171.129
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[3-DEHYDROQUINATE-DEHYDRATASE-RXN]]
 +
* [[SHIKIMATE-5-DEHYDROGENASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[ESTRADIOL-17-BETA-DEHYDROGENASE-RXN]]
+
* [[3-DEHYDROQUINATE-DEHYDRATASE-RXN]]
 +
* [[RXN-7968]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=17β-estradiol}}
+
{{#set: common-name=3-dehydroshikimate}}
{{#set: inchi-key=inchikey=voxzdwnpvjitmn-zbrfxrbcsa-n}}
+
{{#set: inchi-key=inchikey=slwwjzmphjjoph-phdidxhhsa-m}}
{{#set: molecular-weight=272.386}}
+
{{#set: molecular-weight=171.129}}

Revision as of 08:28, 15 March 2021

Metabolite 3-DEHYDRO-SHIKIMATE

  • common-name:
    • 3-dehydroshikimate
  • smiles:
    • c([o-])(=o)c1(=cc(=o)c(o)c(o)c1)
  • inchi-key:
    • slwwjzmphjjoph-phdidxhhsa-m
  • molecular-weight:
    • 171.129

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality