Difference between revisions of "FERULIC-ACID"

From metabolic_network
Jump to navigation Jump to search
(Created page with "Category:metabolite == Metabolite FERULIC-ACID == * common-name: ** ferulate * smiles: ** coc1(=cc(c=cc([o-])=o)=cc=c(o)1) * inchi-key: ** ksebmyqbyztdhs-hwkanzrosa-m * mo...")
(Created page with "Category:metabolite == Metabolite CPD-12699 == * common-name: ** (2r)-2-hydroxy-2-methylbutanenitrile * smiles: ** ccc(c)(o)c#n * inchi-key: ** vmehotodtpxckt-yfkpbyrvsa-n...")
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite FERULIC-ACID ==
+
== Metabolite CPD-12699 ==
 
* common-name:
 
* common-name:
** ferulate
+
** (2r)-2-hydroxy-2-methylbutanenitrile
 
* smiles:
 
* smiles:
** coc1(=cc(c=cc([o-])=o)=cc=c(o)1)
+
** ccc(c)(o)c#n
 
* inchi-key:
 
* inchi-key:
** ksebmyqbyztdhs-hwkanzrosa-m
+
** vmehotodtpxckt-yfkpbyrvsa-n
 
* molecular-weight:
 
* molecular-weight:
** 193.179
+
** 99.132
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[6.2.1.34-RXN]]
 
* [[RXN-1121]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[3.1.1.73-RXN]]
+
* [[RXN-9674]]
* [[RXN-1104]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=ferulate}}
+
{{#set: common-name=(2r)-2-hydroxy-2-methylbutanenitrile}}
{{#set: inchi-key=inchikey=ksebmyqbyztdhs-hwkanzrosa-m}}
+
{{#set: inchi-key=inchikey=vmehotodtpxckt-yfkpbyrvsa-n}}
{{#set: molecular-weight=193.179}}
+
{{#set: molecular-weight=99.132}}

Revision as of 11:12, 15 January 2021

Metabolite CPD-12699

  • common-name:
    • (2r)-2-hydroxy-2-methylbutanenitrile
  • smiles:
    • ccc(c)(o)c#n
  • inchi-key:
    • vmehotodtpxckt-yfkpbyrvsa-n
  • molecular-weight:
    • 99.132

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality