Difference between revisions of "CPD-18761"

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(Created page with "Category:metabolite == Metabolite CPD-12199 == * common-name: ** 3s-(4-hydroxyphenyl)-3-hydroxy-propanoyl-coa * smiles: ** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc(o)c1(=cc=c(o)...")
(Created page with "Category:metabolite == Metabolite CPD-18761 == * common-name: ** coniferyl alcohol radical * smiles: ** coc1(=cc(=ccco)c=cc(=o)1) * inchi-key: ** orajwsykrgvtdp-uhfffaoysa...")
 
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-12199 ==
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== Metabolite CPD-18761 ==
 
* common-name:
 
* common-name:
** 3s-(4-hydroxyphenyl)-3-hydroxy-propanoyl-coa
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** coniferyl alcohol radical
 
* smiles:
 
* smiles:
** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc(o)c1(=cc=c(o)c=c1))cop(=o)(op(=o)(occ2(c(op([o-])(=o)[o-])c(o)c(o2)n4(c3(=c(c(n)=nc=n3)n=c4))))[o-])[o-]
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** coc1(=cc(=ccco)c=cc(=o)1)
 
* inchi-key:
 
* inchi-key:
** vddfxumtxcqmfm-ugdqnksbsa-j
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** orajwsykrgvtdp-uhfffaoysa-n
 
* molecular-weight:
 
* molecular-weight:
** 927.663
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** 179.195
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-11245]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-11244]]
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* [[RXN-17351]]
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* [[RXN-17352]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3s-(4-hydroxyphenyl)-3-hydroxy-propanoyl-coa}}
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{{#set: common-name=coniferyl alcohol radical}}
{{#set: inchi-key=inchikey=vddfxumtxcqmfm-ugdqnksbsa-j}}
+
{{#set: inchi-key=inchikey=orajwsykrgvtdp-uhfffaoysa-n}}
{{#set: molecular-weight=927.663}}
+
{{#set: molecular-weight=179.195}}

Latest revision as of 11:12, 18 March 2021

Metabolite CPD-18761

  • common-name:
    • coniferyl alcohol radical
  • smiles:
    • coc1(=cc(=ccco)c=cc(=o)1)
  • inchi-key:
    • orajwsykrgvtdp-uhfffaoysa-n
  • molecular-weight:
    • 179.195

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality