Difference between revisions of "N-ACETYL-9-O-ACETYLNEURAMINATE"

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(Created page with "Category:metabolite == Metabolite CPD-11524 == * common-name: ** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3-oxohexanoyl)-coa * smiles: ** ccc=ccc1(c(ccc(=o)1)cccc(=o)cc(s...")
(Created page with "Category:metabolite == Metabolite N-ACETYL-9-O-ACETYLNEURAMINATE == * common-name: ** n-acetyl-9-o-acetylneuraminate * smiles: ** cc(nc1(c(cc(o)(c(=o)[o-])oc1c(c(coc(=o)c)...")
 
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-11524 ==
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== Metabolite N-ACETYL-9-O-ACETYLNEURAMINATE ==
 
* common-name:
 
* common-name:
** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3-oxohexanoyl)-coa
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** n-acetyl-9-o-acetylneuraminate
 
* smiles:
 
* smiles:
** ccc=ccc1(c(ccc(=o)1)cccc(=o)cc(sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ2(c(op([o-])(=o)[o-])c(o)c(o2)n4(c3(=c(c(n)=nc=n3)n=c4))))[o-])[o-])=o)
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** cc(nc1(c(cc(o)(c(=o)[o-])oc1c(c(coc(=o)c)o)o)o))=o
 
* inchi-key:
 
* inchi-key:
** adgirvmshggghu-azvxsvfwsa-j
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** nywzbrwkdrmpas-gyqvtdhrsa-m
 
* molecular-weight:
 
* molecular-weight:
** 1025.85
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** 350.302
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-10700]]
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* [[RXN-7864]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-10702]]
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* [[RXN-7864]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3-oxohexanoyl)-coa}}
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{{#set: common-name=n-acetyl-9-o-acetylneuraminate}}
{{#set: inchi-key=inchikey=adgirvmshggghu-azvxsvfwsa-j}}
+
{{#set: inchi-key=inchikey=nywzbrwkdrmpas-gyqvtdhrsa-m}}
{{#set: molecular-weight=1025.85}}
+
{{#set: molecular-weight=350.302}}

Latest revision as of 11:12, 18 March 2021

Metabolite N-ACETYL-9-O-ACETYLNEURAMINATE

  • common-name:
    • n-acetyl-9-o-acetylneuraminate
  • smiles:
    • cc(nc1(c(cc(o)(c(=o)[o-])oc1c(c(coc(=o)c)o)o)o))=o
  • inchi-key:
    • nywzbrwkdrmpas-gyqvtdhrsa-m
  • molecular-weight:
    • 350.302

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality