Difference between revisions of "CPD-19150"

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(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-]) *...")
(Created page with "Category:metabolite == Metabolite CPD-19150 == * common-name: ** (2e,5z)-dodecenoyl-coa * smiles: ** ccccccc=ccc=cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op...")
 
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite 34-DEHYDRO-14-THIOMORPHOLINE-3-CARBOXY ==
+
== Metabolite CPD-19150 ==
 
* common-name:
 
* common-name:
** 3,4-dehydrothiomorpholine-3-carboxylate
+
** (2e,5z)-dodecenoyl-coa
 
* smiles:
 
* smiles:
** c1(cscc(=n1)c(=o)[o-])
+
** ccccccc=ccc=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:
** hrxjcqxgahsujc-uhfffaoysa-m
+
** zsjrxhrcabosnc-shjpognxsa-j
 
* molecular-weight:
 
* molecular-weight:
** 144.168
+
** 941.776
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[1.5.1.25-RXN]]
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* [[RXN-17797]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-17796]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3,4-dehydrothiomorpholine-3-carboxylate}}
+
{{#set: common-name=(2e,5z)-dodecenoyl-coa}}
{{#set: inchi-key=inchikey=hrxjcqxgahsujc-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=zsjrxhrcabosnc-shjpognxsa-j}}
{{#set: molecular-weight=144.168}}
+
{{#set: molecular-weight=941.776}}

Latest revision as of 11:15, 18 March 2021

Metabolite CPD-19150

  • common-name:
    • (2e,5z)-dodecenoyl-coa
  • smiles:
    • ccccccc=ccc=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:
    • zsjrxhrcabosnc-shjpognxsa-j
  • molecular-weight:
    • 941.776

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality