Difference between revisions of "CPDQT-28"

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(Created page with "Category:metabolite == Metabolite 3-METHYL-1-246-TRIHYDROXYPHENYLBUTAN == * common-name: ** phlorisovalerophenone * smiles: ** cc(cc(c1(c(=cc(=cc=1o)o)o))=o)c * inchi-key:...")
(Created page with "Category:metabolite == Metabolite CPD1G-0 == * common-name: ** 1-(2-amino-2-deoxy-α-d-glucopyranosyl)-1d-myo-inositol * smiles: ** c(o)c2(c(c(c([n+])c(oc1(c(o)c(o)c(...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite 3-METHYL-1-246-TRIHYDROXYPHENYLBUTAN ==
+
== Metabolite CPD1G-0 ==
 
* common-name:
 
* common-name:
** phlorisovalerophenone
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** 1-(2-amino-2-deoxy-α-d-glucopyranosyl)-1d-myo-inositol
 
* smiles:
 
* smiles:
** cc(cc(c1(c(=cc(=cc=1o)o)o))=o)c
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** c(o)c2(c(c(c([n+])c(oc1(c(o)c(o)c(o)c(o)c(o)1))o2)o)o)
 
* inchi-key:
 
* inchi-key:
** vsdwhzgjgwmirn-uhfffaoysa-n
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** hepuigaczyvucd-lfikjohqsa-o
 
* molecular-weight:
 
* molecular-weight:
** 210.229
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** 342.322
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-7811]]
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* [[RXN1G-121]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=phlorisovalerophenone}}
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{{#set: common-name=1-(2-amino-2-deoxy-α-d-glucopyranosyl)-1d-myo-inositol}}
{{#set: inchi-key=inchikey=vsdwhzgjgwmirn-uhfffaoysa-n}}
+
{{#set: inchi-key=inchikey=hepuigaczyvucd-lfikjohqsa-o}}
{{#set: molecular-weight=210.229}}
+
{{#set: molecular-weight=342.322}}

Revision as of 11:12, 15 January 2021

Metabolite CPD1G-0

  • common-name:
    • 1-(2-amino-2-deoxy-α-d-glucopyranosyl)-1d-myo-inositol
  • smiles:
    • c(o)c2(c(c(c([n+])c(oc1(c(o)c(o)c(o)c(o)c(o)1))o2)o)o)
  • inchi-key:
    • hepuigaczyvucd-lfikjohqsa-o
  • molecular-weight:
    • 342.322

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality