Difference between revisions of "MALONATE-S-ALD"

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(Created page with "Category:metabolite == Metabolite HOMO-CIS-ACONITATE == * common-name: ** cis-homoaconitate * smiles: ** c(=o)([o-])c=c(ccc([o-])=o)c(=o)[o-] * inchi-key: ** bjypzfuwwjsak...")
(Created page with "Category:metabolite == Metabolite MALONATE-S-ALD == * common-name: ** 3-oxopropanoate * smiles: ** [ch](=o)cc([o-])=o * inchi-key: ** oakurxizzoaybc-uhfffaoysa-m * molecul...")
 
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite HOMO-CIS-ACONITATE ==
+
== Metabolite MALONATE-S-ALD ==
 
* common-name:
 
* common-name:
** cis-homoaconitate
+
** 3-oxopropanoate
 
* smiles:
 
* smiles:
** c(=o)([o-])c=c(ccc([o-])=o)c(=o)[o-]
+
** [ch](=o)cc([o-])=o
 
* inchi-key:
 
* inchi-key:
** bjypzfuwwjsakc-arjawskdsa-k
+
** oakurxizzoaybc-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 185.113
+
** 87.055
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[HOMOACONITATE-HYDRATASE-RXN]]
+
* [[1.2.1.18-RXN]]
 +
* [[RXN-2901]]
 +
* [[RXN-2902]]
 +
* [[RXN-9958]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[HOMOACONITATE-HYDRATASE-RXN]]
+
* [[1.2.1.18-RXN]]
 +
* [[RXN-16322]]
 +
* [[RXN-2901]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=cis-homoaconitate}}
+
{{#set: common-name=3-oxopropanoate}}
{{#set: inchi-key=inchikey=bjypzfuwwjsakc-arjawskdsa-k}}
+
{{#set: inchi-key=inchikey=oakurxizzoaybc-uhfffaoysa-m}}
{{#set: molecular-weight=185.113}}
+
{{#set: molecular-weight=87.055}}

Latest revision as of 11:16, 18 March 2021

Metabolite MALONATE-S-ALD

  • common-name:
    • 3-oxopropanoate
  • smiles:
    • [ch](=o)cc([o-])=o
  • inchi-key:
    • oakurxizzoaybc-uhfffaoysa-m
  • molecular-weight:
    • 87.055

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality