Difference between revisions of "CPD-787"

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(Created page with "Category:metabolite == Metabolite CPD-15153 == * common-name: ** 3-methyl-6-methoxy-2-octaprenyl-1,4-benzoquinone * smiles: ** cc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c...")
(Created page with "Category:metabolite == Metabolite DIHYDRO-DIOH-BENZOATE == * common-name: ** (2s,3s)-2,3-dihydroxy-2,3-dihydrobenzoate * smiles: ** c([o-])(=o)c1(=cc=cc(c1o)o) * inchi-key...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-15153 ==
+
== Metabolite DIHYDRO-DIOH-BENZOATE ==
 
* common-name:
 
* common-name:
** 3-methyl-6-methoxy-2-octaprenyl-1,4-benzoquinone
+
** (2s,3s)-2,3-dihydroxy-2,3-dihydrobenzoate
 
* smiles:
 
* smiles:
** cc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=ccc1(c(=o)c(oc)=cc(=o)c(c)=1)
+
** c([o-])(=o)c1(=cc=cc(c1o)o)
 
* inchi-key:
 
* inchi-key:
** flybtlrocqbhmr-kfsstaeesa-n
+
** incswykiciyahb-wdskdsinsa-m
 
* molecular-weight:
 
* molecular-weight:
** 697.095
+
** 155.13
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[DHBDEHYD-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-14177]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3-methyl-6-methoxy-2-octaprenyl-1,4-benzoquinone}}
+
{{#set: common-name=(2s,3s)-2,3-dihydroxy-2,3-dihydrobenzoate}}
{{#set: inchi-key=inchikey=flybtlrocqbhmr-kfsstaeesa-n}}
+
{{#set: inchi-key=inchikey=incswykiciyahb-wdskdsinsa-m}}
{{#set: molecular-weight=697.095}}
+
{{#set: molecular-weight=155.13}}

Revision as of 15:00, 5 January 2021

Metabolite DIHYDRO-DIOH-BENZOATE

  • common-name:
    • (2s,3s)-2,3-dihydroxy-2,3-dihydrobenzoate
  • smiles:
    • c([o-])(=o)c1(=cc=cc(c1o)o)
  • inchi-key:
    • incswykiciyahb-wdskdsinsa-m
  • molecular-weight:
    • 155.13

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality