Difference between revisions of "CPD1F-130"

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(Created page with "Category:metabolite == Metabolite OXALATE == * common-name: ** oxalate * smiles: ** c([o-])(c(=o)[o-])=o * inchi-key: ** mubzpkhoepujkr-uhfffaoysa-l * molecular-weight: **...")
(Created page with "Category:metabolite == Metabolite CPD-19157 == * common-name: ** 3-oxo-(7z)-tetradecenoyl-coa * smiles: ** ccccccc=ccccc(=o)cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o...")
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite OXALATE ==
+
== Metabolite CPD-19157 ==
 
* common-name:
 
* common-name:
** oxalate
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** 3-oxo-(7z)-tetradecenoyl-coa
 
* smiles:
 
* smiles:
** c([o-])(c(=o)[o-])=o
+
** ccccccc=ccccc(=o)cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-]
 
* inchi-key:
 
* inchi-key:
** mubzpkhoepujkr-uhfffaoysa-l
+
** bepllrgjvxaeji-twafkmgksa-j
 
* molecular-weight:
 
* molecular-weight:
** 88.02
+
** 985.829
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[OXALATE-DECARBOXYLASE-RXN]]
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* [[RXN-17795]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[GLYOXYLATE-OXIDASE-RXN]]
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* [[RXN-17794]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=oxalate}}
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{{#set: common-name=3-oxo-(7z)-tetradecenoyl-coa}}
{{#set: inchi-key=inchikey=mubzpkhoepujkr-uhfffaoysa-l}}
+
{{#set: inchi-key=inchikey=bepllrgjvxaeji-twafkmgksa-j}}
{{#set: molecular-weight=88.02}}
+
{{#set: molecular-weight=985.829}}

Revision as of 15:26, 5 January 2021

Metabolite CPD-19157

  • common-name:
    • 3-oxo-(7z)-tetradecenoyl-coa
  • smiles:
    • ccccccc=ccccc(=o)cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-]
  • inchi-key:
    • bepllrgjvxaeji-twafkmgksa-j
  • molecular-weight:
    • 985.829

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality