Difference between revisions of "CPDQT-27"

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(Created page with "Category:metabolite == Metabolite CPD-18390 == * common-name: ** 1-palmitoyl-2-myristoyl phosphatidate * smiles: ** cccccccccccccccc(=o)occ(cop(=o)([o-])[o-])oc(cccccccccc...")
(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...")
 
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-18390 ==
+
== Metabolite CPDQT-27 ==
 
* common-name:
 
* common-name:
** 1-palmitoyl-2-myristoyl phosphatidate
+
** 6-(methylthio)-2-oxohexanoate
 
* smiles:
 
* smiles:
** cccccccccccccccc(=o)occ(cop(=o)([o-])[o-])oc(ccccccccccccc)=o
+
** csccccc(=o)c([o-])=o
 
* inchi-key:
 
* inchi-key:
** gloxzzhezykxnv-wjokgbtcsa-l
+
** grugzhaoxopasc-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 618.83
+
** 175.222
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-17023]]
+
* [[RXNQT-4165]]
* [[RXN-17024]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=1-palmitoyl-2-myristoyl phosphatidate}}
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{{#set: common-name=6-(methylthio)-2-oxohexanoate}}
{{#set: inchi-key=inchikey=gloxzzhezykxnv-wjokgbtcsa-l}}
+
{{#set: inchi-key=inchikey=grugzhaoxopasc-uhfffaoysa-m}}
{{#set: molecular-weight=618.83}}
+
{{#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