Difference between revisions of "CPD-14485"

Revision as of 15:24, 5 January 2021

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-17046 ==
+== Metabolite CPD-108 ==
 * common-name:
-** 3-benzyl-3,6 -bis(glutathione)- 6-(hydroxymethyl)-diketopiperazine
+** 4-methylphenol
 * smiles:
-** c(sc2(cc1(=cc=cc=c1))(nc(=o)c(scc(c(ncc([o-])=o)=o)nc(=o)ccc([n+])c([o-])=o)(co)nc(=o)2))c(c(ncc([o-])=o)=o)nc(=o)ccc([n+])c([o-])=o
+** cc1(c=cc(=cc=1)o)
 * inchi-key:
-** yjisldwviydioe-wgtgpsahsa-l
+** iwdclrjobjjrnh-uhfffaoysa-n
 * molecular-weight:
-** 842.848
+** 108.14
 == Reaction(s) known to consume the compound ==
-* [[RXN-15681]]
+* [[RXN-15588]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-15680]]
+* [[RXN-11319]]
+* [[RXN-15588]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=3-benzyl-3,6 -bis(glutathione)- 6-(hydroxymethyl)-diketopiperazine}}
+{{#set: common-name=4-methylphenol}}
-{{#set: inchi-key=inchikey=yjisldwviydioe-wgtgpsahsa-l}}
+{{#set: inchi-key=inchikey=iwdclrjobjjrnh-uhfffaoysa-n}}
-{{#set: molecular-weight=842.848}}
+{{#set: molecular-weight=108.14}}