Difference between revisions of "CPD1F-437"

Latest revision as of 11:16, 18 March 2021

common-name:
- quercetin-3-glucoside
smiles:
- c1(c=c(o)c(o)=cc=1c3(oc4(c=c([o-])c=c(o)c(c(=o)c(oc2(oc(co)c(o)c(o)c(o)2))=3)=4)))
inchi-key:
- ovsqvdmcbvzwgm-qsofnflrsa-m
molecular-weight:
- 463.374

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-11444 ==
+== Metabolite CPD1F-437 ==
 * common-name:
-** uroporphyrinogen-i
+** quercetin-3-glucoside
 * 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))
+** c1(c=c(o)c(o)=cc=1c3(oc4(c=c([o-])c=c(o)c(c(=o)c(oc2(oc(co)c(o)c(o)c(o)2))=3)=4)))
 * inchi-key:
-** qttnoskslatgqb-uhfffaoysa-f
+** ovsqvdmcbvzwgm-qsofnflrsa-m
 * molecular-weight:
-** 828.742
+** 463.374
 == Reaction(s) known to consume the compound ==
-* [[RXN-10642]]
 == Reaction(s) known to produce the compound ==
+* [[RXN1F-462]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=uroporphyrinogen-i}}
+{{#set: common-name=quercetin-3-glucoside}}
-{{#set: inchi-key=inchikey=qttnoskslatgqb-uhfffaoysa-f}}
+{{#set: inchi-key=inchikey=ovsqvdmcbvzwgm-qsofnflrsa-m}}
-{{#set: molecular-weight=828.742}}
+{{#set: molecular-weight=463.374}}