Difference between revisions of "CPD-14123"

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(Created page with "Category:metabolite == Metabolite CPD-14282 == * common-name: ** trans-lignocer-2-enoyl-coa * smiles: ** cccccccccccccccccccccc=cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o...")
(Created page with "Category:metabolite == Metabolite 34-DEHYDRO-14-THIOMORPHOLINE-3-CARBOXY == * common-name: ** 3,4-dehydrothiomorpholine-3-carboxylate * smiles: ** c1(cscc(=n1)c(=o)[o-]) *...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-14282 ==
+
== Metabolite 34-DEHYDRO-14-THIOMORPHOLINE-3-CARBOXY ==
 
* common-name:
 
* common-name:
** trans-lignocer-2-enoyl-coa
+
** 3,4-dehydrothiomorpholine-3-carboxylate
 
* smiles:
 
* smiles:
** cccccccccccccccccccccc=cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op([o-])(=o)occ1(c(op(=o)([o-])[o-])c(o)c(o1)n3(c=nc2(c(n)=nc=nc=23))))=o
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** c1(cscc(=n1)c(=o)[o-])
 
* inchi-key:
 
* inchi-key:
** uvjkzcsqlmwpmv-lqjawxtisa-j
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** hrxjcqxgahsujc-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 1112.113
+
** 144.168
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-13308]]
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* [[1.5.1.25-RXN]]
* [[TRANS-2-ENOYL-COA-REDUCTASE-NAD+-RXN-CPD-10280/NAD//CPD-14282/NADH/PROTON.37.]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-13304]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=trans-lignocer-2-enoyl-coa}}
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{{#set: common-name=3,4-dehydrothiomorpholine-3-carboxylate}}
{{#set: inchi-key=inchikey=uvjkzcsqlmwpmv-lqjawxtisa-j}}
+
{{#set: inchi-key=inchikey=hrxjcqxgahsujc-uhfffaoysa-m}}
{{#set: molecular-weight=1112.113}}
+
{{#set: molecular-weight=144.168}}

Revision as of 11:17, 15 January 2021

Metabolite 34-DEHYDRO-14-THIOMORPHOLINE-3-CARBOXY

  • common-name:
    • 3,4-dehydrothiomorpholine-3-carboxylate
  • smiles:
    • c1(cscc(=n1)c(=o)[o-])
  • inchi-key:
    • hrxjcqxgahsujc-uhfffaoysa-m
  • molecular-weight:
    • 144.168

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality