Difference between revisions of "GLT"

Revision as of 08:27, 15 March 2021

common-name:
- fucosterol
inchi-key:
- oselkochbmdkej-jugjngjrsa-n
molecular-weight:
- 412.698
smiles:
- cc=c(c(c)c)cc[c@@h](c)[c@@h]3(cc[c@@h]4([c@h]2(cc=c1(c[c@@h](o)cc[c@@](c)1[c@h]2cc[c@](c)34))))

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite 4-DEOXY-BETA-D-GLUC-4-ENURONOSYL-6S ==
+== Metabolite CPD-22095 ==
 * common-name:
-** 4-deoxy-&beta;-d-gluc-4-enuronosyl-(1,3)-n-acetyl--d-galactosamine 6-sulfate
+** fucosterol
-* 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)
 * inchi-key:
-** bujztfindcqrgp-ztvljyeesa-l
+** oselkochbmdkej-jugjngjrsa-n
 * molecular-weight:
-** 457.362
+** 412.698
+* smiles:
+** cc=c(c(c)c)cc[c@@h](c)[c@@h]3(cc[c@@h]4([c@h]2(cc=c1(c[c@@h](o)cc[c@@](c)1[c@h]2cc[c@](c)34))))
 == Reaction(s) known to consume the compound ==
-* [[RXN-12177]]
 == Reaction(s) known to produce the compound ==
+* [[RXN-22198]]
 == 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=fucosterol}}
-{{#set: inchi-key=inchikey=bujztfindcqrgp-ztvljyeesa-l}}
+{{#set: inchi-key=inchikey=oselkochbmdkej-jugjngjrsa-n}}
-{{#set: molecular-weight=457.362}}
+{{#set: molecular-weight=412.698}}