Difference between revisions of "CPD-17070"

Latest revision as of 11:14, 18 March 2021

common-name:
- fe-coproporphyrin iii
smiles:
- cc1(=c8(c=c4(c(c)=c(ccc([o-])=o)c5(c=c3(c(ccc([o-])=o)=c(c)c2(=cc7(c(ccc(=o)[o-])=c(c)c6(=cc(=c(ccc([o-])=o)1)n([fe--](n23)([n+]4=5)[n+]6=7)8))))))))
inchi-key:
- sxdinbxhohhtmy-rggahwmasa-h
molecular-weight:
- 704.518

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-17063 ==
+== Metabolite CPD-17070 ==
 * common-name:
-** ferroheme o
+** fe-coproporphyrin iii
 * smiles:
-** c=cc4(=c(c)c8(=[n+]5([fe--]26([n+]1(=c(c(c)=c(ccc(=o)[o-])c1=cc3(n2c(=c(c)c(ccc(=o)[o-])=3)c=c45))c=c7(c(c)=c(c(o)ccc=c(ccc=c(c)ccc=c(c)c)c)c(n67)=c8))))))
+** cc1(=c8(c=c4(c(c)=c(ccc([o-])=o)c5(c=c3(c(ccc([o-])=o)=c(c)c2(=cc7(c(ccc(=o)[o-])=c(c)c6(=cc(=c(ccc([o-])=o)1)n([fe--](n23)([n+]4=5)[n+]6=7)8))))))))
 * inchi-key:
-** fispassvcdrerw-arqjtvbpsa-j
+** sxdinbxhohhtmy-rggahwmasa-h
 * molecular-weight:
-** 836.852
+** 704.518
 == Reaction(s) known to consume the compound ==
 == Reaction(s) known to produce the compound ==
-* [[HEMEOSYN-RXN]]
+* [[RXN-17518]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=ferroheme o}}
+{{#set: common-name=fe-coproporphyrin iii}}
-{{#set: inchi-key=inchikey=fispassvcdrerw-arqjtvbpsa-j}}
+{{#set: inchi-key=inchikey=sxdinbxhohhtmy-rggahwmasa-h}}
-{{#set: molecular-weight=836.852}}
+{{#set: molecular-weight=704.518}}