Difference between revisions of "CPD-17070"

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(Created page with "Category:metabolite == Metabolite CPD-17063 == * common-name: ** ferroheme o * smiles: ** c=cc4(=c(c)c8(=[n+]5([fe--]26([n+]1(=c(c(c)=c(ccc(=o)[o-])c1=cc3(n2c(=c(c)c(ccc(=...")
(Created page with "Category:metabolite == Metabolite CPD-19488 == * common-name: ** 3-isopropyl-9-(methylthio)-2-oxononanoate * smiles: ** csccccccc(c(=o)c(=o)[o-])c(=o)[o-] * inchi-key: **...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-17063 ==
+
== Metabolite CPD-19488 ==
 
* common-name:
 
* common-name:
** ferroheme o
+
** 3-isopropyl-9-(methylthio)-2-oxononanoate
 
* smiles:
 
* smiles:
** c=cc4(=c(c)c8(=[n+]5([fe--]26([n+]1(=c(c(c)=c(ccc(=o)[o-])c1=cc3(n2c(=c(c)c(ccc(=o)[o-])=3)c=c45))c=c7(c(c)=c(c(o)ccc=c(ccc=c(c)ccc=c(c)c)c)c(n67)=c8))))))
+
** csccccccc(c(=o)c(=o)[o-])c(=o)[o-]
 
* inchi-key:
 
* inchi-key:
** fispassvcdrerw-arqjtvbpsa-j
+
** pbyokogrhhzthq-uhfffaoysa-l
 
* molecular-weight:
 
* molecular-weight:
** 836.852
+
** 260.304
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-18202]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[HEMEOSYN-RXN]]
+
* [[RXN-18202]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=ferroheme o}}
+
{{#set: common-name=3-isopropyl-9-(methylthio)-2-oxononanoate}}
{{#set: inchi-key=inchikey=fispassvcdrerw-arqjtvbpsa-j}}
+
{{#set: inchi-key=inchikey=pbyokogrhhzthq-uhfffaoysa-l}}
{{#set: molecular-weight=836.852}}
+
{{#set: molecular-weight=260.304}}

Revision as of 11:16, 15 January 2021

Metabolite CPD-19488

  • common-name:
    • 3-isopropyl-9-(methylthio)-2-oxononanoate
  • smiles:
    • csccccccc(c(=o)c(=o)[o-])c(=o)[o-]
  • inchi-key:
    • pbyokogrhhzthq-uhfffaoysa-l
  • molecular-weight:
    • 260.304

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality