Difference between revisions of "SJ08954"

Revision as of 14:20, 26 August 2019

common-name:
- triiodothyroacetate ether glucuronide
smiles:
- c(=o)([o-])cc1(c=c(i)c(=c(i)c=1)oc3(=cc(i)=c(oc2(oc(c([o-])=o)c(o)c(o)c(o)2))c=c3))
inchi-key:
- vxvbzmwowmhxtq-kfyubchvsa-l
molecular-weight:
- 796.046

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6741 CPD-6741] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11410 CPD-11410] ==
 * common-name:
-** d-myo-inositol (1,2,3,5,6) pentakisphosphate
+** triiodothyroacetate ether glucuronide
 * smiles:
-** c1(o)(c(op(=o)([o-])[o-])c(op([o-])(=o)[o-])c(op([o-])([o-])=o)c(op(=o)([o-])[o-])c(op(=o)([o-])[o-])1)
+** c(=o)([o-])cc1(c=c(i)c(=c(i)c=1)oc3(=cc(i)=c(oc2(oc(c([o-])=o)c(o)c(o)c(o)2))c=c3))
 * inchi-key:
-** ctpqaxvnygzuaj-uotptpdrsa-d
+** vxvbzmwowmhxtq-kfyubchvsa-l
 * molecular-weight:
-** 569.977
+** 796.046
 == Reaction(s) known to consume the compound ==
 == Reaction(s) known to produce the compound ==
-* [[RXN-7241]]
+* [[RXN-10619]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=d-myo-inositol (1,2,3,5,6) pentakisphosphate}}
+{{#set: common-name=triiodothyroacetate ether glucuronide}}
-{{#set: inchi-key=inchikey=ctpqaxvnygzuaj-uotptpdrsa-d}}
+{{#set: inchi-key=inchikey=vxvbzmwowmhxtq-kfyubchvsa-l}}
-{{#set: molecular-weight=569.977}}
+{{#set: molecular-weight=796.046}}