Difference between revisions of "CPD-7158"

Latest revision as of 11:13, 18 March 2021

common-name:
- 3-demethylubiquinol-9
smiles:
- cc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=ccc1(=c(c)c(o)=c(o)c(oc)=c(o)1)
inchi-key:
- alajatogwwbpqt-nscwjznlsa-n
molecular-weight:
- 783.228

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-558 ==
+== Metabolite CPD-7158 ==
 * common-name:
-** pimeloyl-coa
+** 3-demethylubiquinol-9
 * smiles:
-** cc(c)(c(o)c(=o)nccc(=o)nccsc(cccccc([o-])=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-]
+** cc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=ccc1(=c(c)c(o)=c(o)c(oc)=c(o)1)
 * inchi-key:
-** lycrxmtyuzduga-uyrkptjqsa-i
+** alajatogwwbpqt-nscwjznlsa-n
 * molecular-weight:
-** 904.649
+** 783.228
 == Reaction(s) known to consume the compound ==
-* [[7KAPSYN-RXN]]
+* [[2.1.1.64-RXN]]
 == Reaction(s) known to produce the compound ==
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=pimeloyl-coa}}
+{{#set: common-name=3-demethylubiquinol-9}}
-{{#set: inchi-key=inchikey=lycrxmtyuzduga-uyrkptjqsa-i}}
+{{#set: inchi-key=inchikey=alajatogwwbpqt-nscwjznlsa-n}}
-{{#set: molecular-weight=904.649}}
+{{#set: molecular-weight=783.228}}