Difference between revisions of "CPD-14675"

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(Created page with "Category:metabolite == Metabolite CPDQT-37 == * common-name: ** 3-[(4'-methylthio)butyl]malate * smiles: ** csccccc(c(o)c(=o)[o-])c(=o)[o-] * inchi-key: ** zizldvklmyvmnx-...")
(Created page with "Category:metabolite == Metabolite CPD-14675 == * common-name: ** pristanoyl-coa * smiles: ** cc(c)cccc(c)cccc(c)cccc(c)c(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1...")
 
(6 intermediate revisions by 3 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPDQT-37 ==
+
== Metabolite CPD-14675 ==
 
* common-name:
 
* common-name:
** 3-[(4'-methylthio)butyl]malate
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** pristanoyl-coa
 
* smiles:
 
* smiles:
** csccccc(c(o)c(=o)[o-])c(=o)[o-]
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** cc(c)cccc(c)cccc(c)cccc(c)c(=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-]
 
* inchi-key:
 
* inchi-key:
** zizldvklmyvmnx-uhfffaoysa-l
+
** xyjpsqpvcbnzht-tukysrjdsa-j
 
* molecular-weight:
 
* molecular-weight:
** 234.267
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** 1043.995
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-18206]]
 
* [[RXNQT-4168]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-18206]]
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* [[RXN66-484]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3-[(4'-methylthio)butyl]malate}}
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{{#set: common-name=pristanoyl-coa}}
{{#set: inchi-key=inchikey=zizldvklmyvmnx-uhfffaoysa-l}}
+
{{#set: inchi-key=inchikey=xyjpsqpvcbnzht-tukysrjdsa-j}}
{{#set: molecular-weight=234.267}}
+
{{#set: molecular-weight=1043.995}}

Latest revision as of 11:12, 18 March 2021

Metabolite CPD-14675

  • common-name:
    • pristanoyl-coa
  • smiles:
    • cc(c)cccc(c)cccc(c)cccc(c)c(=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-]
  • inchi-key:
    • xyjpsqpvcbnzht-tukysrjdsa-j
  • molecular-weight:
    • 1043.995

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality