Difference between revisions of "SJ04593"

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(Created page with "Category:metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13174 CPD-13174] == * common-name: ** salicyl-6-hydroxy-2-cyclohexene-on-oyl * smiles: ** c...")
 
(Created page with "Category:metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-9459 CPD-9459] == * common-name: ** oleanolate * smiles: ** cc3(c[ch]4(c2(=cc[ch]5(c1(ccc(c...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13174 CPD-13174] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-9459 CPD-9459] ==
 
* common-name:
 
* common-name:
** salicyl-6-hydroxy-2-cyclohexene-on-oyl
+
** oleanolate
 
* smiles:
 
* smiles:
** c(c1(o)(c(=o)ccc=c1))(occ2(c(o)=cc=cc=2))=o
+
** cc3(c[ch]4(c2(=cc[ch]5(c1(ccc(c([ch]1ccc(c2(ccc(cc3)4c([o-])=o)c)5c)(c)c)o)c))))c
 
* inchi-key:
 
* inchi-key:
** wyymyyoxcoemcu-uhfffaoysa-n
+
** mijyxulnpsfwek-gtofxwbisa-m
 
* molecular-weight:
 
* molecular-weight:
** 262.262
+
** 455.699
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-12252]]
+
* [[RXN-9000]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=salicyl-6-hydroxy-2-cyclohexene-on-oyl}}
+
{{#set: common-name=oleanolate}}
{{#set: inchi-key=inchikey=wyymyyoxcoemcu-uhfffaoysa-n}}
+
{{#set: inchi-key=inchikey=mijyxulnpsfwek-gtofxwbisa-m}}
{{#set: molecular-weight=262.262}}
+
{{#set: molecular-weight=455.699}}

Revision as of 14:20, 26 August 2019

Metabolite CPD-9459

  • common-name:
    • oleanolate
  • smiles:
    • cc3(c[ch]4(c2(=cc[ch]5(c1(ccc(c([ch]1ccc(c2(ccc(cc3)4c([o-])=o)c)5c)(c)c)o)c))))c
  • inchi-key:
    • mijyxulnpsfwek-gtofxwbisa-m
  • molecular-weight:
    • 455.699

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality