Difference between revisions of "CPD-22765"

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(Created page with "Category:metabolite == Metabolite HEXANOATE == * common-name: ** hexanoate * smiles: ** cccccc([o-])=o * inchi-key: ** fuzzwvxgsfpdmh-uhfffaoysa-m * molecular-weight: ** 1...")
(Created page with "Category:metabolite == Metabolite CPD-674 == * common-name: ** trans-cinnamate * smiles: ** c(=o)([o-])c=cc1(=cc=cc=c1) * inchi-key: ** wbywaxjhaxsjni-votsokgwsa-m * molec...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite HEXANOATE ==
+
== Metabolite CPD-674 ==
 
* common-name:
 
* common-name:
** hexanoate
+
** trans-cinnamate
 
* smiles:
 
* smiles:
** cccccc([o-])=o
+
** c(=o)([o-])c=cc1(=cc=cc=c1)
 
* inchi-key:
 
* inchi-key:
** fuzzwvxgsfpdmh-uhfffaoysa-m
+
** wbywaxjhaxsjni-votsokgwsa-m
 
* molecular-weight:
 
* molecular-weight:
** 115.152
+
** 147.153
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-2001]]
 +
* [[TRANS-CINNAMATE-4-MONOOXYGENASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[3.1.2.19-RXN-HEXANOYL-COA/WATER//HEXANOATE/CO-A/PROTON.42.]]
 
* [[ACECOATRANS-RXN-HEXANOYL-COA/ACET//HEXANOATE/ACETYL-COA.40.]]
 
* [[THIOESTER-RXN[CCO-CYTOSOL]-HEXANOYL-COA/WATER//HEXANOATE/CO-A/PROTON.55.]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=hexanoate}}
+
{{#set: common-name=trans-cinnamate}}
{{#set: inchi-key=inchikey=fuzzwvxgsfpdmh-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=wbywaxjhaxsjni-votsokgwsa-m}}
{{#set: molecular-weight=115.152}}
+
{{#set: molecular-weight=147.153}}

Revision as of 08:31, 15 March 2021

Metabolite CPD-674

  • common-name:
    • trans-cinnamate
  • smiles:
    • c(=o)([o-])c=cc1(=cc=cc=c1)
  • inchi-key:
    • wbywaxjhaxsjni-votsokgwsa-m
  • molecular-weight:
    • 147.153

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality