Difference between revisions of "CPDQT-29"

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(Created page with "Category:metabolite == Metabolite CPD-465 == * common-name: ** presqualene diphosphate * smiles: ** cc(=cccc(=cccc(=cc1(c(c)(ccc=c(ccc=c(c)c)c)c1cop(op([o-])([o-])=o)([o-]...")
(Created page with "Category:metabolite == Metabolite CPDQT-29 == * common-name: ** 8-(methylthio)-2-oxooctanoate * smiles: ** csccccccc(=o)c([o-])=o * inchi-key: ** qdznkmgehahota-uhfffaoysa...")
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-465 ==
+
== Metabolite CPDQT-29 ==
 
* common-name:
 
* common-name:
** presqualene diphosphate
+
** 8-(methylthio)-2-oxooctanoate
 
* smiles:
 
* smiles:
** cc(=cccc(=cccc(=cc1(c(c)(ccc=c(ccc=c(c)c)c)c1cop(op([o-])([o-])=o)([o-])=o))c)c)c
+
** csccccccc(=o)c([o-])=o
 
* inchi-key:
 
* inchi-key:
** atzkauggnmsccy-qlydttawsa-k
+
** qdznkmgehahota-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 583.66
+
** 203.276
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-13724]]
 
* [[RXN66-281]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-12263]]
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* [[RXNQT-4171]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=presqualene diphosphate}}
+
{{#set: common-name=8-(methylthio)-2-oxooctanoate}}
{{#set: inchi-key=inchikey=atzkauggnmsccy-qlydttawsa-k}}
+
{{#set: inchi-key=inchikey=qdznkmgehahota-uhfffaoysa-m}}
{{#set: molecular-weight=583.66}}
+
{{#set: molecular-weight=203.276}}

Revision as of 18:59, 14 January 2021

Metabolite CPDQT-29

  • common-name:
    • 8-(methylthio)-2-oxooctanoate
  • smiles:
    • csccccccc(=o)c([o-])=o
  • inchi-key:
    • qdznkmgehahota-uhfffaoysa-m
  • molecular-weight:
    • 203.276

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality