Difference between revisions of "ITACONATE"

From metabolic_network
Jump to navigation Jump to search
(Created page with "Category:metabolite == Metabolite CPD-7105 == * common-name: ** deoxyhumulone * smiles: ** cc(=ccc1(=c(c(=c(c(=c1[o-])cc=c(c)c)o)c(cc(c)c)=o)o))c * inchi-key: ** nqybqbzoh...")
(Created page with "Category:metabolite == Metabolite ITACONATE == * common-name: ** itaconate * smiles: ** c=c(c(=o)[o-])cc([o-])=o * inchi-key: ** lvhbhzanlowsrm-uhfffaoysa-l * molecular-we...")
 
(5 intermediate revisions by 2 users not shown)
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-7105 ==
+
== Metabolite ITACONATE ==
 
* common-name:
 
* common-name:
** deoxyhumulone
+
** itaconate
 
* smiles:
 
* smiles:
** cc(=ccc1(=c(c(=c(c(=c1[o-])cc=c(c)c)o)c(cc(c)c)=o)o))c
+
** c=c(c(=o)[o-])cc([o-])=o
 
* inchi-key:
 
* inchi-key:
** nqybqbzohcaccr-uhfffaoysa-m
+
** lvhbhzanlowsrm-uhfffaoysa-l
 
* molecular-weight:
 
* molecular-weight:
** 345.458
+
** 128.084
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-8988]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-7810]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=deoxyhumulone}}
+
{{#set: common-name=itaconate}}
{{#set: inchi-key=inchikey=nqybqbzohcaccr-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=lvhbhzanlowsrm-uhfffaoysa-l}}
{{#set: molecular-weight=345.458}}
+
{{#set: molecular-weight=128.084}}

Latest revision as of 11:15, 18 March 2021

Metabolite ITACONATE

  • common-name:
    • itaconate
  • smiles:
    • c=c(c(=o)[o-])cc([o-])=o
  • inchi-key:
    • lvhbhzanlowsrm-uhfffaoysa-l
  • molecular-weight:
    • 128.084

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality