Difference between revisions of "CPD-329"

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(Created page with "Category:metabolite == Metabolite CPD-13357 == * common-name: ** (2r)-2,3-dihydroxy-3-methylbutanoate * smiles: ** cc(c)(o)c(o)c(=o)[o-] * inchi-key: ** jteykufkxgdteu-vkh...")
(Created page with "Category:metabolite == Metabolite DEHYDROQUINATE == * common-name: ** 3-dehydroquinate * smiles: ** c(=o)([o-])c1(o)(cc(=o)c(o)c(o)c1) * inchi-key: ** wvmwzwgzraxubk-sytvj...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-13357 ==
+
== Metabolite DEHYDROQUINATE ==
 
* common-name:
 
* common-name:
** (2r)-2,3-dihydroxy-3-methylbutanoate
+
** 3-dehydroquinate
 
* smiles:
 
* smiles:
** cc(c)(o)c(o)c(=o)[o-]
+
** c(=o)([o-])c1(o)(cc(=o)c(o)c(o)c1)
 
* inchi-key:
 
* inchi-key:
** jteykufkxgdteu-vkhmyheasa-m
+
** wvmwzwgzraxubk-sytvjdicsa-m
 
* molecular-weight:
 
* molecular-weight:
** 133.124
+
** 189.144
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[DIHYDROXYISOVALDEHYDRAT-RXN]]
+
* [[3-DEHYDROQUINATE-DEHYDRATASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[ACETOLACTREDUCTOISOM-RXN]]
+
* [[3-DEHYDROQUINATE-DEHYDRATASE-RXN]]
* [[KARI_LPAREN_23dhmb_RPAREN_]]
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* [[3-DEHYDROQUINATE-SYNTHASE-RXN]]
 +
* [[RXN-10032]]
 +
* [[RXN-7967]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=(2r)-2,3-dihydroxy-3-methylbutanoate}}
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{{#set: common-name=3-dehydroquinate}}
{{#set: inchi-key=inchikey=jteykufkxgdteu-vkhmyheasa-m}}
+
{{#set: inchi-key=inchikey=wvmwzwgzraxubk-sytvjdicsa-m}}
{{#set: molecular-weight=133.124}}
+
{{#set: molecular-weight=189.144}}

Revision as of 15:27, 5 January 2021

Metabolite DEHYDROQUINATE

  • common-name:
    • 3-dehydroquinate
  • smiles:
    • c(=o)([o-])c1(o)(cc(=o)c(o)c(o)c1)
  • inchi-key:
    • wvmwzwgzraxubk-sytvjdicsa-m
  • molecular-weight:
    • 189.144

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality