Difference between revisions of "CPD-15661"

Latest revision as of 11:17, 18 March 2021

common-name:
- 2-trans, 4-trans-undecadienoyl-coa
smiles:
- ccccccc=cc=cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)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-]
inchi-key:
- szkpluulggerfd-msnzeopqsa-j
molecular-weight:
- 927.749

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite S-24-DINITROPHENYLGLUTATHIONE ==
+== Metabolite CPD-15661 ==
 * common-name:
-** 2,4-dinitrophenyl-s-glutathione
+** 2-trans, 4-trans-undecadienoyl-coa
 * 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)
+** ccccccc=cc=cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)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-]
 * inchi-key:
-** fxeukvkgtkddiq-uwvggrqhsa-m
+** szkpluulggerfd-msnzeopqsa-j
 * molecular-weight:
-** 472.406
+** 927.749
 == Reaction(s) known to consume the compound ==
-* [[GST-RXN]]
+* [[RXN-14790]]
+* [[RXN-14791]]
 == Reaction(s) known to produce the compound ==
-* [[GST-RXN]]
+* [[RXN-14789]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=2,4-dinitrophenyl-s-glutathione}}
+{{#set: common-name=2-trans, 4-trans-undecadienoyl-coa}}
-{{#set: inchi-key=inchikey=fxeukvkgtkddiq-uwvggrqhsa-m}}
+{{#set: inchi-key=inchikey=szkpluulggerfd-msnzeopqsa-j}}
-{{#set: molecular-weight=472.406}}
+{{#set: molecular-weight=927.749}}