Difference between revisions of "COB-I-ALAMIN"

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(Created page with "Category:metabolite == Metabolite CPD-12014 == * common-name: ** 6-hydroxymelatonin * smiles: ** cc(=o)nccc1(=cnc2(c1=cc(oc)=c(o)c=2)) * inchi-key: ** omymrcxojjzyke-uhfff...")
(Created page with "Category:metabolite == Metabolite CPD-8614 == * common-name: ** 4α-methyl-5α-cholesta-8-en-3-one * smiles: ** cc(c)cccc([ch]4(c1(c)([ch](c2(=c(cc1)c3(c)([ch](c...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-12014 ==
+
== Metabolite CPD-8614 ==
 
* common-name:
 
* common-name:
** 6-hydroxymelatonin
+
** 4α-methyl-5α-cholesta-8-en-3-one
 
* smiles:
 
* smiles:
** cc(=o)nccc1(=cnc2(c1=cc(oc)=c(o)c=2))
+
** cc(c)cccc([ch]4(c1(c)([ch](c2(=c(cc1)c3(c)([ch](cc2)c(c)c(=o)cc3)))cc4)))c
 
* inchi-key:
 
* inchi-key:
** omymrcxojjzyke-uhfffaoysa-n
+
** sdzuxffgoqzlpk-sinuoacosa-n
 
* molecular-weight:
 
* molecular-weight:
** 248.281
+
** 398.671
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-11058]]
+
* [[RXN66-19]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-11056]]
+
* [[RXN66-18]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=6-hydroxymelatonin}}
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{{#set: common-name=4α-methyl-5α-cholesta-8-en-3-one}}
{{#set: inchi-key=inchikey=omymrcxojjzyke-uhfffaoysa-n}}
+
{{#set: inchi-key=inchikey=sdzuxffgoqzlpk-sinuoacosa-n}}
{{#set: molecular-weight=248.281}}
+
{{#set: molecular-weight=398.671}}

Revision as of 13:08, 14 January 2021

Metabolite CPD-8614

  • common-name:
    • 4α-methyl-5α-cholesta-8-en-3-one
  • smiles:
    • cc(c)cccc([ch]4(c1(c)([ch](c2(=c(cc1)c3(c)([ch](cc2)c(c)c(=o)cc3)))cc4)))c
  • inchi-key:
    • sdzuxffgoqzlpk-sinuoacosa-n
  • molecular-weight:
    • 398.671

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality