Difference between revisions of "CPD-18437"

Latest revision as of 11:14, 18 March 2021

common-name:
- 3-hydroxy-4-methyl-anthranilate pentapeptide lactone
smiles:
- cc(c)c1(c(=o)n3([ch](c(n(c)cc(n(c(c(c)c)c(=o)oc(c)c(c(n1)=o)nc(=o)c2(c=cc(c)=c(c(n)=2)o))c)=o)=o)ccc3))
inchi-key:
- idanitfecicajb-mpkzyahhsa-n
molecular-weight:
- 630.74

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite 4-DEOXY-BETA-D-GLUC-4-ENURONOSYL-6S ==
+== Metabolite CPD-18437 ==
 * common-name:
-** 4-deoxy-&beta;-d-gluc-4-enuronosyl-(1,3)-n-acetyl--d-galactosamine 6-sulfate
+** 3-hydroxy-4-methyl-anthranilate pentapeptide lactone
 * smiles:
-** cc(=o)nc2(c(o)oc(cos(=o)(=o)[o-])c(o)c(oc1(oc(c([o-])=o)=cc(o)c(o)1))2)
+** cc(c)c1(c(=o)n3([ch](c(n(c)cc(n(c(c(c)c)c(=o)oc(c)c(c(n1)=o)nc(=o)c2(c=cc(c)=c(c(n)=2)o))c)=o)=o)ccc3))
 * inchi-key:
-** bujztfindcqrgp-ztvljyeesa-l
+** idanitfecicajb-mpkzyahhsa-n
 * molecular-weight:
-** 457.362
+** 630.74
 == Reaction(s) known to consume the compound ==
-* [[RXN-12177]]
+* [[RXN-17067]]
 == Reaction(s) known to produce the compound ==
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=4-deoxy-&beta;-d-gluc-4-enuronosyl-(1,3)-n-acetyl--d-galactosamine 6-sulfate}}
+{{#set: common-name=3-hydroxy-4-methyl-anthranilate pentapeptide lactone}}
-{{#set: inchi-key=inchikey=bujztfindcqrgp-ztvljyeesa-l}}
+{{#set: inchi-key=inchikey=idanitfecicajb-mpkzyahhsa-n}}
-{{#set: molecular-weight=457.362}}
+{{#set: molecular-weight=630.74}}