Difference between revisions of "CPD-248"

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(Created page with "Category:metabolite == Metabolite 4-METHYL-824-CHOLESTADIENOL == * common-name: ** 4α-methyl-zymosterol * smiles: ** cc(c)=cccc(c)[ch]3(cc[ch]4(c2(cc[ch]1(c(c)c(o)cc...")
(Created page with "Category:metabolite == Metabolite CPD-248 == * common-name: ** 2-formylaminobenzaldehyde * smiles: ** c(c1(c(=cc=cc=1)nc=o))=o * inchi-key: ** pvimspyddgdctg-uhfffaoysa-n...")
 
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite 4-METHYL-824-CHOLESTADIENOL ==
+
== Metabolite CPD-248 ==
 
* common-name:
 
* common-name:
** 4α-methyl-zymosterol
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** 2-formylaminobenzaldehyde
 
* smiles:
 
* smiles:
** cc(c)=cccc(c)[ch]3(cc[ch]4(c2(cc[ch]1(c(c)c(o)ccc(c)1c=2ccc(c)34))))
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** c(c1(c(=cc=cc=1)nc=o))=o
 
* inchi-key:
 
* inchi-key:
** foujwbxbkvvhcj-yijygbtnsa-n
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** pvimspyddgdctg-uhfffaoysa-n
 
* molecular-weight:
 
* molecular-weight:
** 398.671
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** 149.149
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-13709]]
 
* [[RXN-13709-4-METHYL-824-CHOLESTADIENOL/NADH/OXYGEN-MOLECULE/PROTON//CPD-4702/NAD/WATER.76.]]
 
* [[RXN-13709-4-METHYL-824-CHOLESTADIENOL/NADPH/OXYGEN-MOLECULE/PROTON//CPD-4702/NADP/WATER.78.]]
 
* [[RXN11884]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN11878]]
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* [[INDOLE-23-DIOXYGENASE-RXN]]
* [[RXN11884]]
 
* [[RXN66-314]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=4α-methyl-zymosterol}}
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{{#set: common-name=2-formylaminobenzaldehyde}}
{{#set: inchi-key=inchikey=foujwbxbkvvhcj-yijygbtnsa-n}}
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{{#set: inchi-key=inchikey=pvimspyddgdctg-uhfffaoysa-n}}
{{#set: molecular-weight=398.671}}
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{{#set: molecular-weight=149.149}}

Latest revision as of 11:15, 18 March 2021

Metabolite CPD-248

  • common-name:
    • 2-formylaminobenzaldehyde
  • smiles:
    • c(c1(c(=cc=cc=1)nc=o))=o
  • inchi-key:
    • pvimspyddgdctg-uhfffaoysa-n
  • molecular-weight:
    • 149.149

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality