Difference between revisions of "CPD-11878"

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(Created page with "Category:metabolite == Metabolite SQUALENE == * common-name: ** squalene * smiles: ** cc(c)=cccc(c)=cccc(c)=cccc=c(c)ccc=c(c)ccc=c(c)c * inchi-key: ** yygntywphwgjrm-aajyl...")
(Created page with "Category:metabolite == Metabolite 1-O-SINAPOYL-BETA-D-GLUCOSE == * common-name: ** 1-o-sinapoyl-β-d-glucose * smiles: ** coc2(=cc(c=cc(=o)oc1(c(o)c(c(c(o1)co)o)o))=cc...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite SQUALENE ==
+
== Metabolite 1-O-SINAPOYL-BETA-D-GLUCOSE ==
 
* common-name:
 
* common-name:
** squalene
+
** 1-o-sinapoyl-β-d-glucose
 
* smiles:
 
* smiles:
** cc(c)=cccc(c)=cccc(c)=cccc=c(c)ccc=c(c)ccc=c(c)c
+
** coc2(=cc(c=cc(=o)oc1(c(o)c(c(c(o1)co)o)o))=cc(=c(o)2)oc)
 
* inchi-key:
 
* inchi-key:
** yygntywphwgjrm-aajylucbsa-n
+
** xrkbrpftfkkhef-dgdbgzaxsa-n
 
* molecular-weight:
 
* molecular-weight:
** 410.725
+
** 386.355
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[SMO]]
+
* [[2.3.1.91-RXN]]
* [[SQUALENE-MONOOXYGENASE-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-13162]]
 
* [[RXN-13724]]
 
* [[RXN66-281]]
 
* [[SMO]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=squalene}}
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{{#set: common-name=1-o-sinapoyl-β-d-glucose}}
{{#set: inchi-key=inchikey=yygntywphwgjrm-aajylucbsa-n}}
+
{{#set: inchi-key=inchikey=xrkbrpftfkkhef-dgdbgzaxsa-n}}
{{#set: molecular-weight=410.725}}
+
{{#set: molecular-weight=386.355}}

Revision as of 15:29, 5 January 2021

Metabolite 1-O-SINAPOYL-BETA-D-GLUCOSE

  • common-name:
    • 1-o-sinapoyl-β-d-glucose
  • smiles:
    • coc2(=cc(c=cc(=o)oc1(c(o)c(c(c(o1)co)o)o))=cc(=c(o)2)oc)
  • inchi-key:
    • xrkbrpftfkkhef-dgdbgzaxsa-n
  • molecular-weight:
    • 386.355

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality