Difference between revisions of "CPDQT-27"

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(Created page with "Category:metabolite == Metabolite 3-HYDROXY-PROPIONYL-COA == * common-name: ** 3-hydroxypropanoyl-coa * smiles: ** cc(c)(c(o)c(=o)nccc(=o)nccsc(cco)=o)cop(=o)(op(=o)(occ1(...")
(Created page with "Category:metabolite == Metabolite CPDQT-27 == * common-name: ** 6-(methylthio)-2-oxohexanoate * smiles: ** csccccc(=o)c([o-])=o * inchi-key: ** grugzhaoxopasc-uhfffaoysa-m...")
 
(6 intermediate revisions by 3 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite 3-HYDROXY-PROPIONYL-COA ==
+
== Metabolite CPDQT-27 ==
 
* common-name:
 
* common-name:
** 3-hydroxypropanoyl-coa
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** 6-(methylthio)-2-oxohexanoate
 
* smiles:
 
* smiles:
** cc(c)(c(o)c(=o)nccc(=o)nccsc(cco)=o)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-]
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** csccccc(=o)c([o-])=o
 
* inchi-key:
 
* inchi-key:
** berbfzcusmqabm-iexphmlfsa-j
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** grugzhaoxopasc-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 835.566
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** 175.222
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[HICH]]
 
* [[RXN-6383]]
 
* [[RXN-6384]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-6383]]
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* [[RXNQT-4165]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3-hydroxypropanoyl-coa}}
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{{#set: common-name=6-(methylthio)-2-oxohexanoate}}
{{#set: inchi-key=inchikey=berbfzcusmqabm-iexphmlfsa-j}}
+
{{#set: inchi-key=inchikey=grugzhaoxopasc-uhfffaoysa-m}}
{{#set: molecular-weight=835.566}}
+
{{#set: molecular-weight=175.222}}

Latest revision as of 11:12, 18 March 2021

Metabolite CPDQT-27

  • common-name:
    • 6-(methylthio)-2-oxohexanoate
  • smiles:
    • csccccc(=o)c([o-])=o
  • inchi-key:
    • grugzhaoxopasc-uhfffaoysa-m
  • molecular-weight:
    • 175.222

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality