Difference between revisions of "CPD0-2123"

Revision as of 15:09, 15 March 2021

common-name:
- cobalt-precorrin-7
molecular-weight:
- 917.827
inchi-key:
- gpkqhtavldbecx-lbshsciksa-f
smiles:
- cc6(c7(c(c([ch]8(c2(n1([co--]4([n+]3(=c(c=c1c(ccc([o-])=o)c(cc(=o)[o-])(c)2)c(c(ccc(=o)[o-])=c3cc5(c(=c(ccc(=o)[o-])c(=[n+]45)6)c)c)(cc(=o)[o-])c))[n+]=78))c))cc(=o)[o-])(c)ccc(=o)[o-]))

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-19158 ==
+== Metabolite CPD-9048 ==
 * common-name:
-** 3-oxo-(9z)-hexadecenoyl-coa
+** cobalt-precorrin-7
 * molecular-weight:
-** 1013.883
+** 917.827
 * inchi-key:
-** jdnargywmlyada-mdmkaecgsa-j
+** gpkqhtavldbecx-lbshsciksa-f
 * smiles:
-** ccccccc=ccccccc(=o)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-]
+** cc6(c7(c(c([ch]8(c2(n1([co--]4([n+]3(=c(c=c1c(ccc([o-])=o)c(cc(=o)[o-])(c)2)c(c(ccc(=o)[o-])=c3cc5(c(=c(ccc(=o)[o-])c(=[n+]45)6)c)c)(cc(=o)[o-])c))[n+]=78))c))cc(=o)[o-])(c)ccc(=o)[o-]))
 == Reaction(s) known to consume the compound ==
-* [[RXN-17791]]
+* [[RXN-8767]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-17790]]
+* [[RXN-8766]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=3-oxo-(9z)-hexadecenoyl-coa}}
+{{#set: common-name=cobalt-precorrin-7}}
-{{#set: molecular-weight=1013.883}}
+{{#set: molecular-weight=917.827}}
-{{#set: inchi-key=inchikey=jdnargywmlyada-mdmkaecgsa-j}}
+{{#set: inchi-key=inchikey=gpkqhtavldbecx-lbshsciksa-f}}