Difference between revisions of "3-HYDROXY-3-METHYL-GLUTARYL-COA"

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(Created page with "Category:metabolite == Metabolite CPD-8613 == * common-name: ** 4α-carboxy-4β-methyl-5α-cholesta-8-en-3β-ol * smiles: ** cc(c)cccc([ch]4(c1(c)([ch](c...")
(Created page with "Category:metabolite == Metabolite 3-HYDROXY-3-METHYL-GLUTARYL-COA == * common-name: ** (s)-3-hydroxy-3-methylglutaryl-coa * smiles: ** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc(c...")
 
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[[Category:metabolite]]
 
[[Category:metabolite]]
−
== Metabolite CPD-8613 ==
+
== Metabolite 3-HYDROXY-3-METHYL-GLUTARYL-COA ==
 
* common-name:
 
* common-name:
−
** 4α-carboxy-4β-methyl-5α-cholesta-8-en-3β-ol
+
** (s)-3-hydroxy-3-methylglutaryl-coa
 
* smiles:
 
* smiles:
−
** cc(c)cccc([ch]4(c1(c)([ch](c2(=c(cc1)c3(c)([ch](cc2)c(c)(c([o-])=o)c(o)cc3)))cc4)))c
+
** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc(c)(o)cc(=o)[o-])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:
−
** glcdbdrqlzkkoj-ljaizbfvsa-m
+
** cabvtrnmfuvudm-vrhqgpglsa-i
 
* molecular-weight:
 
* molecular-weight:
−
** 443.688
+
** 906.621
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN66-18]]
+
* [[1.1.1.34-RXN]]
 +
* [[HYDROXYMETHYLGLUTARYL-COA-LYASE-RXN]]
 +
* [[HYDROXYMETHYLGLUTARYL-COA-SYNTHASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[1.1.1.34-RXN]]
 +
* [[HYDROXYMETHYLGLUTARYL-COA-SYNTHASE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
{{#set: common-name=4α-carboxy-4β-methyl-5α-cholesta-8-en-3β-ol}}
+
{{#set: common-name=(s)-3-hydroxy-3-methylglutaryl-coa}}
−
{{#set: inchi-key=inchikey=glcdbdrqlzkkoj-ljaizbfvsa-m}}
+
{{#set: inchi-key=inchikey=cabvtrnmfuvudm-vrhqgpglsa-i}}
−
{{#set: molecular-weight=443.688}}
+
{{#set: molecular-weight=906.621}}

Latest revision as of 11:16, 18 March 2021

Metabolite 3-HYDROXY-3-METHYL-GLUTARYL-COA

  • common-name:
    • (s)-3-hydroxy-3-methylglutaryl-coa
  • smiles:
    • cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc(c)(o)cc(=o)[o-])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:
    • cabvtrnmfuvudm-vrhqgpglsa-i
  • molecular-weight:
    • 906.621

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

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