Difference between revisions of "CPD-13758"

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(Created page with "Category:metabolite == Metabolite CPD0-934 == * common-name: ** glucosyl-(heptosyl)3-kdo2-lipid a-phosphate * smiles: ** cccccccccccccc(=o)oc(cc(oc2(c(c(occ1(oc(op([o-])(=...")
(Created page with "Category:metabolite == Metabolite CPD-13758 == * common-name: ** 3-[(3as,4s,5r,7as)-5-hydroxy-7a-methyl-1-oxo-octahydro-1h-inden-4-yl]-3-oxopropanoyl-coa * smiles: ** cc(c...")
 
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD0-934 ==
+
== Metabolite CPD-13758 ==
 
* common-name:
 
* common-name:
** glucosyl-(heptosyl)3-kdo2-lipid a-phosphate
+
** 3-[(3as,4s,5r,7as)-5-hydroxy-7a-methyl-1-oxo-octahydro-1h-inden-4-yl]-3-oxopropanoyl-coa
 
* smiles:
 
* smiles:
** cccccccccccccc(=o)oc(cc(oc2(c(c(occ1(oc(op([o-])(=o)[o-])c(nc(=o)cc(o)ccccccccccc)c(oc(=o)cc(o)ccccccccccc)c(o)1))oc(c2op([o-])([o-])=o)coc8(c([o-])=o)(oc(c(o)co)c(oc6(oc(c(co)o)c(c(oc5(oc(c(coc3(oc(c(co)o)c(c(o)c3o)o))o)c(c(oc4(c(c(c(c(co)o4)o)o)o))c5o)o))c6o)op([o-])(=o)[o-]))c(oc7(c(=o)[o-])(oc(c(o)co)c(o)c(o)c7))c8))nc(cc(ccccccccccc)oc(ccccccccccc)=o)=o))=o)ccccccccccc
+
** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc(=o)c1(c(o)ccc2(c)(c(=o)cc[ch]12)))cop(=o)(op(=o)(occ3(c(op([o-])(=o)[o-])c(o)c(o3)n5(c4(=c(c(n)=nc=n4)n=c5))))[o-])[o-]
 
* inchi-key:
 
* inchi-key:
** qhkuhequrqlsfa-jyysnnmzsa-f
+
** ogahroymeoborv-xongilkksa-j
 
* molecular-weight:
 
* molecular-weight:
** 3049.306
+
** 999.769
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-14361]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-12750]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=glucosyl-(heptosyl)3-kdo2-lipid a-phosphate}}
+
{{#set: common-name=3-[(3as,4s,5r,7as)-5-hydroxy-7a-methyl-1-oxo-octahydro-1h-inden-4-yl]-3-oxopropanoyl-coa}}
{{#set: inchi-key=inchikey=qhkuhequrqlsfa-jyysnnmzsa-f}}
+
{{#set: inchi-key=inchikey=ogahroymeoborv-xongilkksa-j}}
{{#set: molecular-weight=3049.306}}
+
{{#set: molecular-weight=999.769}}

Latest revision as of 11:16, 18 March 2021

Metabolite CPD-13758

  • common-name:
    • 3-[(3as,4s,5r,7as)-5-hydroxy-7a-methyl-1-oxo-octahydro-1h-inden-4-yl]-3-oxopropanoyl-coa
  • smiles:
    • cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc(=o)c1(c(o)ccc2(c)(c(=o)cc[ch]12)))cop(=o)(op(=o)(occ3(c(op([o-])(=o)[o-])c(o)c(o3)n5(c4(=c(c(n)=nc=n4)n=c5))))[o-])[o-]
  • inchi-key:
    • ogahroymeoborv-xongilkksa-j
  • molecular-weight:
    • 999.769

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

Property "Common-name" (as page type) with input value "3-[(3as,4s,5r,7as)-5-hydroxy-7a-methyl-1-oxo-octahydro-1h-inden-4-yl]-3-oxopropanoyl-coa" contains invalid characters or is incomplete and therefore can cause unexpected results during a query or annotation process.