Difference between revisions of "SUC"

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(Created page with "Category:metabolite == Metabolite CPD-12852 == * common-name: ** 4α,14α-dimethyl-5α-cholesta-8,24-dien-3β-ol * smiles: ** cc(c)=cccc(c)[ch]3(ccc4(c)...")
(Created page with "Category:metabolite == Metabolite CPD-9925 == * common-name: ** 1,4-dihydroxy-2-naphthoyl-coa * smiles: ** cc(c)(c(o)c(=o)nccc(=o)nccsc(c2(c=c(o)c1(=cc=cc=c1c(o)=2)))=o)co...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-12852 ==
+
== Metabolite CPD-9925 ==
 
* common-name:
 
* common-name:
** 4α,14α-dimethyl-5α-cholesta-8,24-dien-3β-ol
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** 1,4-dihydroxy-2-naphthoyl-coa
 
* smiles:
 
* smiles:
** cc(c)=cccc(c)[ch]3(ccc4(c)(c2(cc[ch]1(c(c)c(o)ccc(c)1c=2ccc(c)34))))
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** cc(c)(c(o)c(=o)nccc(=o)nccsc(c2(c=c(o)c1(=cc=cc=c1c(o)=2)))=o)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:
** klzwthglldrkhd-pmiioqglsa-n
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** pytinlgpkdjurz-hsjnekgzsa-j
 
* molecular-weight:
 
* molecular-weight:
** 412.698
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** 949.669
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-11881]]
 
* [[RXN21165]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN11876]]
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* [[NAPHTHOATE-SYN-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=4α,14α-dimethyl-5α-cholesta-8,24-dien-3β-ol}}
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{{#set: common-name=1,4-dihydroxy-2-naphthoyl-coa}}
{{#set: inchi-key=inchikey=klzwthglldrkhd-pmiioqglsa-n}}
+
{{#set: inchi-key=inchikey=pytinlgpkdjurz-hsjnekgzsa-j}}
{{#set: molecular-weight=412.698}}
+
{{#set: molecular-weight=949.669}}

Revision as of 14:57, 5 January 2021

Metabolite CPD-9925

  • common-name:
    • 1,4-dihydroxy-2-naphthoyl-coa
  • smiles:
    • cc(c)(c(o)c(=o)nccc(=o)nccsc(c2(c=c(o)c1(=cc=cc=c1c(o)=2)))=o)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:
    • pytinlgpkdjurz-hsjnekgzsa-j
  • molecular-weight:
    • 949.669

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality