Difference between revisions of "SJ09795"

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(Created page with "Category:metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-1130 CPD-1130] == * common-name: ** 3-ethylmalate * smiles: ** ccc(c([o-])=o)c(c(=o)[o-])o...")
(Created page with "Category:metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12015 CPD-12015] == * common-name: ** 6-sulfatoxymelatonin * smiles: ** cc(=o)nccc1(c2(=c(n...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-1130 CPD-1130] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12015 CPD-12015] ==
 
* common-name:
 
* common-name:
** 3-ethylmalate
+
** 6-sulfatoxymelatonin
 
* smiles:
 
* smiles:
** ccc(c([o-])=o)c(c(=o)[o-])o
+
** cc(=o)nccc1(c2(=c(nc=1)c=c(os([o-])(=o)=o)c(oc)=c2))
 
* inchi-key:
 
* inchi-key:
** jucrenbzzqkfgk-uhfffaoysa-l
+
** qqeilxdlzrltme-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 160.126
+
** 327.331
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-14986]]
 
* [[RXN-18210]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-18210]]
+
* [[RXN-11058]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3-ethylmalate}}
+
{{#set: common-name=6-sulfatoxymelatonin}}
{{#set: inchi-key=inchikey=jucrenbzzqkfgk-uhfffaoysa-l}}
+
{{#set: inchi-key=inchikey=qqeilxdlzrltme-uhfffaoysa-m}}
{{#set: molecular-weight=160.126}}
+
{{#set: molecular-weight=327.331}}

Revision as of 09:24, 27 August 2019

Metabolite CPD-12015

  • common-name:
    • 6-sulfatoxymelatonin
  • smiles:
    • cc(=o)nccc1(c2(=c(nc=1)c=c(os([o-])(=o)=o)c(oc)=c2))
  • inchi-key:
    • qqeilxdlzrltme-uhfffaoysa-m
  • molecular-weight:
    • 327.331

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality