Difference between revisions of "CPD-8815"

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(Created page with "Category:metabolite == Metabolite COUMARATE == * common-name: ** 4-coumarate * smiles: ** c(=o)([o-])c=cc1(=cc=c(o)c=c1) * inchi-key: ** ngswkaqjjwesns-zzxkwvifsa-m * mole...")
(Created page with "Category:metabolite == Metabolite CPD-8815 == * common-name: ** 2,4-dihydroxybenzoate * smiles: ** cc1(=cc(=c(c=c1)c([o-])=o)o) * inchi-key: ** njesaxzanhetjv-uhfffaoysa-m...")
 
(One intermediate revision by the same user not shown)
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite COUMARATE ==
+
== Metabolite CPD-8815 ==
 
* common-name:
 
* common-name:
** 4-coumarate
+
** 2,4-dihydroxybenzoate
 
* smiles:
 
* smiles:
** c(=o)([o-])c=cc1(=cc=c(o)c=c1)
+
** cc1(=cc(=c(c=c1)c([o-])=o)o)
 
* inchi-key:
 
* inchi-key:
** ngswkaqjjwesns-zzxkwvifsa-m
+
** njesaxzanhetjv-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 163.152
+
** 151.141
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[4-COUMARATE--COA-LIGASE-RXN]]
+
* [[RXN-10078]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[TRANS-CINNAMATE-4-MONOOXYGENASE-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=4-coumarate}}
+
{{#set: common-name=2,4-dihydroxybenzoate}}
{{#set: inchi-key=inchikey=ngswkaqjjwesns-zzxkwvifsa-m}}
+
{{#set: inchi-key=inchikey=njesaxzanhetjv-uhfffaoysa-m}}
{{#set: molecular-weight=163.152}}
+
{{#set: molecular-weight=151.141}}

Latest revision as of 11:11, 18 March 2021

Metabolite CPD-8815

  • common-name:
    • 2,4-dihydroxybenzoate
  • smiles:
    • cc1(=cc(=c(c=c1)c([o-])=o)o)
  • inchi-key:
    • njesaxzanhetjv-uhfffaoysa-m
  • molecular-weight:
    • 151.141

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality