Difference between revisions of "CPD-5662"

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(Created page with "Category:metabolite == Metabolite HOMO-I-CIT == * common-name: ** (1r,2s)-homoisocitrate * smiles: ** c(cc(=o)[o-])c(c(=o)[o-])c(o)c(=o)[o-] * inchi-key: ** oejzzcgrgvfwhk...")
(Created page with "Category:metabolite == Metabolite CPD-5662 == * common-name: ** 9-mercaptodethiobiotin * smiles: ** c(s)c1(c(nc(n1)=o)cccccc(=o)[o-]) * inchi-key: ** zarfdbykhcotrh-uhfffa...")
 
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite HOMO-I-CIT ==
+
== Metabolite CPD-5662 ==
 
* common-name:
 
* common-name:
** (1r,2s)-homoisocitrate
+
** 9-mercaptodethiobiotin
 
* smiles:
 
* smiles:
** c(cc(=o)[o-])c(c(=o)[o-])c(o)c(=o)[o-]
+
** c(s)c1(c(nc(n1)=o)cccccc(=o)[o-])
 
* inchi-key:
 
* inchi-key:
** oejzzcgrgvfwhk-wvzvxsggsa-k
+
** zarfdbykhcotrh-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 203.128
+
** 245.316
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[HOMOACONITATE-HYDRATASE-RXN]]
+
* [[RXN-17473]]
* [[RXN-13722]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[HOMOACONITATE-HYDRATASE-RXN]]
+
* [[RXN-17472]]
* [[RXN-13722]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=(1r,2s)-homoisocitrate}}
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{{#set: common-name=9-mercaptodethiobiotin}}
{{#set: inchi-key=inchikey=oejzzcgrgvfwhk-wvzvxsggsa-k}}
+
{{#set: inchi-key=inchikey=zarfdbykhcotrh-uhfffaoysa-m}}
{{#set: molecular-weight=203.128}}
+
{{#set: molecular-weight=245.316}}

Latest revision as of 11:12, 18 March 2021

Metabolite CPD-5662

  • common-name:
    • 9-mercaptodethiobiotin
  • smiles:
    • c(s)c1(c(nc(n1)=o)cccccc(=o)[o-])
  • inchi-key:
    • zarfdbykhcotrh-uhfffaoysa-m
  • molecular-weight:
    • 245.316

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality