Difference between revisions of "Curation"

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(Created page with "Category:metabolite == Metabolite THIAMINE-PYROPHOSPHATE == * smiles: ** cc1([n+](=csc(ccop([o-])(=o)op([o-])(=o)[o-])=1)cc2(c=nc(c)=nc(n)=2)) * common-name: ** thiamine d...")
(Created page with "Category:metabolite == Metabolite 2-ACETO-LACTATE == * smiles: ** cc(=o)c(c)(o)c(=o)[o-] * common-name: ** (s)-2-acetolactate * inchi-key: ** nmdwgegfjubklb-yfkpbyrvsa-m *...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite THIAMINE-PYROPHOSPHATE ==
+
== Metabolite 2-ACETO-LACTATE ==
 
* smiles:
 
* smiles:
** cc1([n+](=csc(ccop([o-])(=o)op([o-])(=o)[o-])=1)cc2(c=nc(c)=nc(n)=2))
+
** cc(=o)c(c)(o)c(=o)[o-]
 
* common-name:
 
* common-name:
** thiamine diphosphate
+
** (s)-2-acetolactate
 
* inchi-key:
 
* inchi-key:
** ayekofbpnlcajy-uhfffaoysa-l
+
** nmdwgegfjubklb-yfkpbyrvsa-m
 
* molecular-weight:
 
* molecular-weight:
** 422.288
+
** 131.108
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-12583]]
+
* [[ACETOLACTREDUCTOISOM-RXN]]
* [[RXN0-3542]]
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* [[RXN-6081]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-12508]]
+
* [[ACETOLACTREDUCTOISOM-RXN]]
* [[RXN0-3542]]
+
* [[ACETOLACTSYN-RXN]]
* [[THIAMIN-PYROPHOSPHOKINASE-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=thiamine diphosphate}}
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{{#set: common-name=(s)-2-acetolactate}}
{{#set: inchi-key=inchikey=ayekofbpnlcajy-uhfffaoysa-l}}
+
{{#set: inchi-key=inchikey=nmdwgegfjubklb-yfkpbyrvsa-m}}
{{#set: molecular-weight=422.288}}
+
{{#set: molecular-weight=131.108}}

Revision as of 18:42, 12 January 2021

Metabolite 2-ACETO-LACTATE

  • smiles:
    • cc(=o)c(c)(o)c(=o)[o-]
  • common-name:
    • (s)-2-acetolactate
  • inchi-key:
    • nmdwgegfjubklb-yfkpbyrvsa-m
  • molecular-weight:
    • 131.108

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality