Difference between revisions of "CPDQT-27"

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(Created page with "Category:metabolite == Metabolite PHYTOL == * common-name: ** phytol * smiles: ** cc(c)cccc(c)cccc(c)cccc(c)=cco * inchi-key: ** botwfxyspfmfnr-pyddkjgssa-n * molecular-we...")
(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...")
 
(5 intermediate revisions by 3 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite PHYTOL ==
+
== Metabolite CPDQT-27 ==
 
* common-name:
 
* common-name:
** phytol
+
** 6-(methylthio)-2-oxohexanoate
 
* smiles:
 
* smiles:
** cc(c)cccc(c)cccc(c)cccc(c)=cco
+
** csccccc(=o)c([o-])=o
 
* inchi-key:
 
* inchi-key:
** botwfxyspfmfnr-pyddkjgssa-n
+
** grugzhaoxopasc-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 296.535
+
** 175.222
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-7683]]
 
* [[RXN66-478]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXNQT-4165]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=phytol}}
+
{{#set: common-name=6-(methylthio)-2-oxohexanoate}}
{{#set: inchi-key=inchikey=botwfxyspfmfnr-pyddkjgssa-n}}
+
{{#set: inchi-key=inchikey=grugzhaoxopasc-uhfffaoysa-m}}
{{#set: molecular-weight=296.535}}
+
{{#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