Difference between revisions of "Beta-D-glucan-w-C-3-substitution"

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(Created page with "Category:metabolite == Metabolite CPD-3945 == * common-name: ** (22α)-hydroxy-campest-4-en-3-one * smiles: ** cc(c)c(c)cc(o)c(c)[ch]3(cc[ch]4([ch]2(ccc1(=cc(=o)ccc(c...")
(Created page with "Category:metabolite == Metabolite CPD-3766 == * common-name: ** menadione * smiles: ** cc2(=cc(c1(c=cc=cc=1c2=o))=o) * inchi-key: ** mjvavzpdrwsrrc-uhfffaoysa-n * molecula...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-3945 ==
+
== Metabolite CPD-3766 ==
 
* common-name:
 
* common-name:
** (22α)-hydroxy-campest-4-en-3-one
+
** menadione
 
* smiles:
 
* smiles:
** cc(c)c(c)cc(o)c(c)[ch]3(cc[ch]4([ch]2(ccc1(=cc(=o)ccc(c)1[ch]2ccc(c)34))))
+
** cc2(=cc(c1(c=cc=cc=1c2=o))=o)
 
* inchi-key:
 
* inchi-key:
** fmfaicdkespfnh-nqmbqapesa-n
+
** mjvavzpdrwsrrc-uhfffaoysa-n
 
* molecular-weight:
 
* molecular-weight:
** 414.67
+
** 172.183
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[NADH-DEHYDROGENASE-QUINONE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-4231]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=(22α)-hydroxy-campest-4-en-3-one}}
+
{{#set: common-name=menadione}}
{{#set: inchi-key=inchikey=fmfaicdkespfnh-nqmbqapesa-n}}
+
{{#set: inchi-key=inchikey=mjvavzpdrwsrrc-uhfffaoysa-n}}
{{#set: molecular-weight=414.67}}
+
{{#set: molecular-weight=172.183}}

Revision as of 18:52, 14 January 2021

Metabolite CPD-3766

  • common-name:
    • menadione
  • smiles:
    • cc2(=cc(c1(c=cc=cc=1c2=o))=o)
  • inchi-key:
    • mjvavzpdrwsrrc-uhfffaoysa-n
  • molecular-weight:
    • 172.183

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality