Difference between revisions of "CPD-7139"

Latest revision as of 11:15, 18 March 2021

common-name:
- delphinidin 3,5-di-o-β-d-glucoside
smiles:
- c(o)c1(c(o)c(o)c(o)c(o1)oc5(c4(c=c(oc2(c(o)c(o)c(o)c(co)o2))c(c3(c=c(o)c(o)=c(o)c=3))=[o+]c=4c=c([o-])c=5)))
inchi-key:
- xctgxgvgjyacei-lcenjuansa-n
molecular-weight:
- 626.524

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite COPROPORPHYRINOGEN_III ==
+== Metabolite CPD-7139 ==
 * common-name:
-** coproporphyrinogen iii
+** delphinidin 3,5-di-o-&beta;-d-glucoside
 * smiles:
-** cc1(=c2(cc5(=c(c)c(ccc([o-])=o)=c(cc4(=c(ccc([o-])=o)c(c)=c(cc3(=c(ccc(=o)[o-])c(c)=c(cc(=c(ccc([o-])=o)1)n2)n3))n4))n5)))
+** c(o)c1(c(o)c(o)c(o)c(o1)oc5(c4(c=c(oc2(c(o)c(o)c(o)c(co)o2))c(c3(c=c(o)c(o)=c(o)c=3))=[o+]c=4c=c([o-])c=5)))
 * inchi-key:
-** niuvhxtxuxofeb-uhfffaoysa-j
+** xctgxgvgjyacei-lcenjuansa-n
 * molecular-weight:
-** 656.734
+** 626.524
 == Reaction(s) known to consume the compound ==
-* [[HEMN-RXN]]
-* [[RXN-17517]]
-* [[RXN0-1461]]
 == Reaction(s) known to produce the compound ==
-* [[UROGENDECARBOX-RXN]]
+* [[RXN-8228]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=coproporphyrinogen iii}}
+{{#set: common-name=delphinidin 3,5-di-o-&beta;-d-glucoside}}
-{{#set: inchi-key=inchikey=niuvhxtxuxofeb-uhfffaoysa-j}}
+{{#set: inchi-key=inchikey=xctgxgvgjyacei-lcenjuansa-n}}
-{{#set: molecular-weight=656.734}}
+{{#set: molecular-weight=626.524}}