Difference between revisions of "CPD-7005"

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(Created page with "Category:metabolite == Metabolite CPD-11975 == * common-name: ** 1-o-(2-acetamido-2-deoxy-α-d-glucopyranosyl)-1d-myo-inositol 3-phosphate * smiles: ** cc(=o)nc2(c(oc...")
(Created page with "Category:metabolite == Metabolite CPD-19489 == * common-name: ** 3-isopropyl-8-(methylthio)-2-oxooctanoate * smiles: ** cscccccc(c(=o)c(=o)[o-])c(=o)[o-] * inchi-key: ** y...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-11975 ==
+
== Metabolite CPD-19489 ==
 
* common-name:
 
* common-name:
** 1-o-(2-acetamido-2-deoxy-α-d-glucopyranosyl)-1d-myo-inositol 3-phosphate
+
** 3-isopropyl-8-(methylthio)-2-oxooctanoate
 
* smiles:
 
* smiles:
** cc(=o)nc2(c(oc1(c(o)c(o)c(o)c(op([o-])(=o)[o-])c(o)1))oc(c(c2o)o)co)
+
** cscccccc(c(=o)c(=o)[o-])c(=o)[o-]
 
* inchi-key:
 
* inchi-key:
** chttvmdqgbocme-dnswdbfxsa-l
+
** yobcouzbifvtfn-uhfffaoysa-l
 
* molecular-weight:
 
* molecular-weight:
** 461.316
+
** 246.278
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-18204]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-6501]]
+
* [[RXN-18204]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=1-o-(2-acetamido-2-deoxy-α-d-glucopyranosyl)-1d-myo-inositol 3-phosphate}}
+
{{#set: common-name=3-isopropyl-8-(methylthio)-2-oxooctanoate}}
{{#set: inchi-key=inchikey=chttvmdqgbocme-dnswdbfxsa-l}}
+
{{#set: inchi-key=inchikey=yobcouzbifvtfn-uhfffaoysa-l}}
{{#set: molecular-weight=461.316}}
+
{{#set: molecular-weight=246.278}}

Revision as of 14:56, 5 January 2021

Metabolite CPD-19489

  • common-name:
    • 3-isopropyl-8-(methylthio)-2-oxooctanoate
  • smiles:
    • cscccccc(c(=o)c(=o)[o-])c(=o)[o-]
  • inchi-key:
    • yobcouzbifvtfn-uhfffaoysa-l
  • molecular-weight:
    • 246.278

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality