Difference between revisions of "CPD-8122"

Latest revision as of 11:15, 18 March 2021

common-name:
- molybdopterin adenine dinucleotide
smiles:
- c(c3(c(c(c(n2(c1(=c(c(=nc=n1)n)n=c2)))o3)o)o))op(op([o-])(=o)occ5(o[ch]4(nc6(n=c(nc(=o)c(n[ch]4c(=c5[s-])s)=6)n))))(=o)[o-]
inchi-key:
- xjxfaxluokqpaq-yprlvjtjsa-k
molecular-weight:
- 721.529

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-15689 ==
+== Metabolite CPD-8122 ==
 * common-name:
-** (2e,5e)-dodeca-2,5-dienoyl-coa
+** molybdopterin adenine dinucleotide
 * smiles:
-** ccccccc=ccc=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-]
+** c(c3(c(c(c(n2(c1(=c(c(=nc=n1)n)n=c2)))o3)o)o))op(op([o-])(=o)occ5(o[ch]4(nc6(n=c(nc(=o)c(n[ch]4c(=c5[s-])s)=6)n))))(=o)[o-]
 * inchi-key:
-** zsjrxhrcabosnc-uovvplbnsa-j
+** xjxfaxluokqpaq-yprlvjtjsa-k
 * molecular-weight:
-** 941.776
+** 721.529
 == Reaction(s) known to consume the compound ==
-* [[RXN-14801]]
+* [[RXN-8348]]
 == Reaction(s) known to produce the compound ==
+* [[RXN-8344]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=(2e,5e)-dodeca-2,5-dienoyl-coa}}
+{{#set: common-name=molybdopterin adenine dinucleotide}}
-{{#set: inchi-key=inchikey=zsjrxhrcabosnc-uovvplbnsa-j}}
+{{#set: inchi-key=inchikey=xjxfaxluokqpaq-yprlvjtjsa-k}}
-{{#set: molecular-weight=941.776}}
+{{#set: molecular-weight=721.529}}