Difference between revisions of "CPD-15661"

Revision as of 15:30, 5 January 2021

common-name:
- 2,4-dinitrophenyl-s-glutathione
smiles:
- c(=o)([o-])cnc(=o)c(nc(=o)ccc([n+])c(=o)[o-])csc1(c=cc([n+]([o-])=o)=cc([n+]([o-])=o)=1)
inchi-key:
- fxeukvkgtkddiq-uwvggrqhsa-m
molecular-weight:
- 472.406

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD0-2184 ==
+== Metabolite S-24-DINITROPHENYLGLUTATHIONE ==
 * common-name:
-** (2z,4e,7e)-2-hydroxy-6-oxonona-2,4,7-triene-1,9-dioate
+** 2,4-dinitrophenyl-s-glutathione
 * smiles:
-** c([o-])(=o)c=cc(=o)c=cc=c(c([o-])=o)o
+** c(=o)([o-])cnc(=o)c(nc(=o)ccc([n+])c(=o)[o-])csc1(c=cc([n+]([o-])=o)=cc([n+]([o-])=o)=1)
 * inchi-key:
-** wcjyzufkktynlb-aritwgjrsa-l
+** fxeukvkgtkddiq-uwvggrqhsa-m
 * molecular-weight:
-** 210.143
+** 472.406
 == Reaction(s) known to consume the compound ==
-* [[RXN-12070]]
+* [[GST-RXN]]
 == Reaction(s) known to produce the compound ==
+* [[GST-RXN]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=(2z,4e,7e)-2-hydroxy-6-oxonona-2,4,7-triene-1,9-dioate}}
+{{#set: common-name=2,4-dinitrophenyl-s-glutathione}}
-{{#set: inchi-key=inchikey=wcjyzufkktynlb-aritwgjrsa-l}}
+{{#set: inchi-key=inchikey=fxeukvkgtkddiq-uwvggrqhsa-m}}
-{{#set: molecular-weight=210.143}}
+{{#set: molecular-weight=472.406}}