Difference between revisions of "SJ18541"

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(Created page with "Category:metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19159 CPD-19159] == * common-name: ** (s)-3-hydroxy-(11z)-octadecenoyl-coa * smiles: ** ccc...")
 
(Created page with "Category:metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BENZENE-NO2 BENZENE-NO2] == * common-name: ** nitrobenzene * smiles: ** c1(=cc=c(c=c1)[n+]([o-]...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19159 CPD-19159] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BENZENE-NO2 BENZENE-NO2] ==
 
* common-name:
 
* common-name:
** (s)-3-hydroxy-(11z)-octadecenoyl-coa
+
** nitrobenzene
 
* smiles:
 
* smiles:
** ccccccc=ccccccccc(o)cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-]
+
** c1(=cc=c(c=c1)[n+]([o-])=o)
 
* inchi-key:
 
* inchi-key:
** scdxbwnpjageek-kboaxvdlsa-j
+
** lqnuzadurlcdlv-uhfffaoysa-n
 
* molecular-weight:
 
* molecular-weight:
** 1043.952
+
** 123.111
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-17786]]
+
* [[RXN-3661]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-17785]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=(s)-3-hydroxy-(11z)-octadecenoyl-coa}}
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{{#set: common-name=nitrobenzene}}
{{#set: inchi-key=inchikey=scdxbwnpjageek-kboaxvdlsa-j}}
+
{{#set: inchi-key=inchikey=lqnuzadurlcdlv-uhfffaoysa-n}}
{{#set: molecular-weight=1043.952}}
+
{{#set: molecular-weight=123.111}}

Revision as of 14:20, 26 August 2019

Metabolite BENZENE-NO2

  • common-name:
    • nitrobenzene
  • smiles:
    • c1(=cc=c(c=c1)[n+]([o-])=o)
  • inchi-key:
    • lqnuzadurlcdlv-uhfffaoysa-n
  • molecular-weight:
    • 123.111

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality