Difference between revisions of "CPD-12905"

Revision as of 11:18, 15 January 2021

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-13758 ==
+== Metabolite CPD-3061 ==
 * common-name:
-** 3-[(3as,4s,5r,7as)-5-hydroxy-7a-methyl-1-oxo-octahydro-1h-inden-4-yl]-3-oxopropanoyl-coa
+** (2s)-liquiritigenin
 * smiles:
-** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc(=o)c1(c(o)ccc2(c)(c(=o)cc[ch]12)))cop(=o)(op(=o)(occ3(c(op([o-])(=o)[o-])c(o)c(o3)n5(c4(=c(c(n)=nc=n4)n=c5))))[o-])[o-]
+** c1(c=c(c=cc=1c3(oc2(=cc(=cc=c2c(c3)=o)o)))o)
 * inchi-key:
-** ogahroymeoborv-xongilkksa-j
+** furuxtvzlhccna-aweznqclsa-n
 * molecular-weight:
-** 999.769
+** 256.257
 == Reaction(s) known to consume the compound ==
 == Reaction(s) known to produce the compound ==
-* [[RXN-12750]]
+* [[RXN-3221]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=3-[(3as,4s,5r,7as)-5-hydroxy-7a-methyl-1-oxo-octahydro-1h-inden-4-yl]-3-oxopropanoyl-coa}}
+{{#set: common-name=(2s)-liquiritigenin}}
-{{#set: inchi-key=inchikey=ogahroymeoborv-xongilkksa-j}}
+{{#set: inchi-key=inchikey=furuxtvzlhccna-aweznqclsa-n}}
-{{#set: molecular-weight=999.769}}
+{{#set: molecular-weight=256.257}}