Difference between revisions of "CPD-1130"

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(Created page with "Category:metabolite == Metabolite CPD-10332 == * common-name: ** gibberellin44 (open lactone form) * smiles: ** c=c1(c2(o)(cc3(c1)(c([ch]4(c(c)(cccc(co)([ch](cc2)3)4)c([o-...")
(Created page with "Category:metabolite == Metabolite CPD-1130 == * common-name: ** 3-ethylmalate * smiles: ** ccc(c([o-])=o)c(c(=o)[o-])o * inchi-key: ** jucrenbzzqkfgk-uhfffaoysa-l * molecu...")
 
(2 intermediate revisions by 2 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-10332 ==
+
== Metabolite CPD-1130 ==
 
* common-name:
 
* common-name:
** gibberellin44 (open lactone form)
+
** 3-ethylmalate
 
* smiles:
 
* smiles:
** c=c1(c2(o)(cc3(c1)(c([ch]4(c(c)(cccc(co)([ch](cc2)3)4)c([o-])=o))c([o-])=o)))
+
** ccc(c([o-])=o)c(c(=o)[o-])o
 
* inchi-key:
 
* inchi-key:
** axeuuxhmkspqai-ytjhipewsa-l
+
** jucrenbzzqkfgk-uhfffaoysa-l
 
* molecular-weight:
 
* molecular-weight:
** 362.422
+
** 160.126
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN1F-168]]
+
* [[RXN-14986]]
 +
* [[RXN-18210]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN1F-167]]
+
* [[RXN-18210]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=gibberellin44 (open lactone form)}}
+
{{#set: common-name=3-ethylmalate}}
{{#set: inchi-key=inchikey=axeuuxhmkspqai-ytjhipewsa-l}}
+
{{#set: inchi-key=inchikey=jucrenbzzqkfgk-uhfffaoysa-l}}
{{#set: molecular-weight=362.422}}
+
{{#set: molecular-weight=160.126}}

Latest revision as of 11:12, 18 March 2021

Metabolite CPD-1130

  • common-name:
    • 3-ethylmalate
  • smiles:
    • ccc(c([o-])=o)c(c(=o)[o-])o
  • inchi-key:
    • jucrenbzzqkfgk-uhfffaoysa-l
  • molecular-weight:
    • 160.126

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality