Difference between revisions of "Long-Chain-Acyl-CoAs"

Revision as of 11:18, 15 January 2021

common-name:
- uroporphyrinogen-i
smiles:
- c(=o)([o-])ccc5(=c4(nc(cc1(nc(=c(cc([o-])=o)c(ccc(=o)[o-])=1)cc2(nc(=c(c(ccc(=o)[o-])=2)cc(=o)[o-])cc3(=c(ccc([o-])=o)c(cc(=o)[o-])=c(n3)c4))))=c(cc(=o)[o-])5))
inchi-key:
- qttnoskslatgqb-uhfffaoysa-f
molecular-weight:
- 828.742

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite 3-HYDROXY-3-METHYL-GLUTARYL-COA ==
+== Metabolite CPD-11444 ==
 * common-name:
-** (s)-3-hydroxy-3-methylglutaryl-coa
+** uroporphyrinogen-i
 * 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-]
+** c(=o)([o-])ccc5(=c4(nc(cc1(nc(=c(cc([o-])=o)c(ccc(=o)[o-])=1)cc2(nc(=c(c(ccc(=o)[o-])=2)cc(=o)[o-])cc3(=c(ccc([o-])=o)c(cc(=o)[o-])=c(n3)c4))))=c(cc(=o)[o-])5))
 * inchi-key:
-** cabvtrnmfuvudm-vrhqgpglsa-i
+** qttnoskslatgqb-uhfffaoysa-f
 * molecular-weight:
-** 906.621
+** 828.742
 == Reaction(s) known to consume the compound ==
-* [[1.1.1.34-RXN]]
+* [[RXN-10642]]
-* [[HYDROXYMETHYLGLUTARYL-COA-LYASE-RXN]]
-* [[HYDROXYMETHYLGLUTARYL-COA-SYNTHASE-RXN]]
 == Reaction(s) known to produce the compound ==
-* [[1.1.1.34-RXN]]
-* [[HYDROXYMETHYLGLUTARYL-COA-SYNTHASE-RXN]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=(s)-3-hydroxy-3-methylglutaryl-coa}}
+{{#set: common-name=uroporphyrinogen-i}}
-{{#set: inchi-key=inchikey=cabvtrnmfuvudm-vrhqgpglsa-i}}
+{{#set: inchi-key=inchikey=qttnoskslatgqb-uhfffaoysa-f}}
-{{#set: molecular-weight=906.621}}
+{{#set: molecular-weight=828.742}}