Difference between revisions of "RXN-19728"

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(Created page with "Category:metabolite == Metabolite CPD-7880 == * common-name: ** dodecanal * inchi-key: ** hfjrkmmybmwead-uhfffaoysa-n * molecular-weight: ** 184.321 * smiles: ** ccccccccc...")
(Created page with "Category:metabolite == Metabolite HOMO-I-CIT == * common-name: ** (1r,2s)-homoisocitrate * inchi-key: ** oejzzcgrgvfwhk-wvzvxsggsa-k * molecular-weight: ** 203.128 * smile...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-7880 ==
+
== Metabolite HOMO-I-CIT ==
 
* common-name:
 
* common-name:
** dodecanal
+
** (1r,2s)-homoisocitrate
 
* inchi-key:
 
* inchi-key:
** hfjrkmmybmwead-uhfffaoysa-n
+
** oejzzcgrgvfwhk-wvzvxsggsa-k
 
* molecular-weight:
 
* molecular-weight:
** 184.321
+
** 203.128
 
* smiles:
 
* smiles:
** ccccccccccc[ch]=o
+
** c(cc(=o)[o-])[c@h](c(=o)[o-])[c@@h](o)c(=o)[o-]
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-16654]]
+
* [[RXN-13722]]
 +
* [[RXN-7970]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-13722]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=dodecanal}}
+
{{#set: common-name=(1r,2s)-homoisocitrate}}
{{#set: inchi-key=inchikey=hfjrkmmybmwead-uhfffaoysa-n}}
+
{{#set: inchi-key=inchikey=oejzzcgrgvfwhk-wvzvxsggsa-k}}
{{#set: molecular-weight=184.321}}
+
{{#set: molecular-weight=203.128}}

Revision as of 09:53, 27 August 2020

Metabolite HOMO-I-CIT

  • common-name:
    • (1r,2s)-homoisocitrate
  • inchi-key:
    • oejzzcgrgvfwhk-wvzvxsggsa-k
  • molecular-weight:
    • 203.128
  • smiles:
    • c(cc(=o)[o-])[c@h](c(=o)[o-])[c@@h](o)c(=o)[o-]

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality