Difference between revisions of "CPD-13377"

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(Created page with "Category:metabolite == Metabolite CPD-17371 == * common-name: ** 18-hydroxylinoleoyl-coa * smiles: ** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cccccccc=ccc=cccccco)cop(=o)(op(=o)(o...")
(Created page with "Category:metabolite == Metabolite CPD-709 == * common-name: ** (5α)-campestan-3-one * smiles: ** cc(c)c(c)ccc(c)[ch]3(cc[ch]4([ch]2(cc[ch]1(cc(=o)ccc(c)1[ch]2ccc(c)3...")
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-17371 ==
+
== Metabolite CPD-709 ==
 
* common-name:
 
* common-name:
** 18-hydroxylinoleoyl-coa
+
** (5α)-campestan-3-one
 
* smiles:
 
* smiles:
** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cccccccc=ccc=cccccco)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-]
+
** cc(c)c(c)ccc(c)[ch]3(cc[ch]4([ch]2(cc[ch]1(cc(=o)ccc(c)1[ch]2ccc(c)34))))
 
* inchi-key:
 
* inchi-key:
** hjegylshikpenr-daxvlclxsa-j
+
** ddjmomhmvfxeqf-jbqstxlysa-n
 
* molecular-weight:
 
* molecular-weight:
** 1041.936
+
** 400.687
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-16118]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-711]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=18-hydroxylinoleoyl-coa}}
+
{{#set: common-name=(5α)-campestan-3-one}}
{{#set: inchi-key=inchikey=hjegylshikpenr-daxvlclxsa-j}}
+
{{#set: inchi-key=inchikey=ddjmomhmvfxeqf-jbqstxlysa-n}}
{{#set: molecular-weight=1041.936}}
+
{{#set: molecular-weight=400.687}}

Revision as of 15:26, 5 January 2021

Metabolite CPD-709

  • common-name:
    • (5α)-campestan-3-one
  • smiles:
    • cc(c)c(c)ccc(c)[ch]3(cc[ch]4([ch]2(cc[ch]1(cc(=o)ccc(c)1[ch]2ccc(c)34))))
  • inchi-key:
    • ddjmomhmvfxeqf-jbqstxlysa-n
  • molecular-weight:
    • 400.687

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality