Difference between revisions of "CPD-1107"

Latest revision as of 11:13, 18 March 2021

common-name:
- d-myo-inositol 1,3,4,5,6-pentakisphosphate
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)
inchi-key:
- ctpqaxvnygzuaj-kxxvrosksa-d
molecular-weight:
- 569.977

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite STRICTOSIDINE ==
+== Metabolite CPD-1107 ==
 * common-name:
-** 3-&alpha;(s)-strictosidine
+** d-myo-inositol 1,3,4,5,6-pentakisphosphate
 * smiles:
-** c=c[ch]4([ch](c[ch]3(c2(nc1(=cc=cc=c1c=2cc[n+]3))))c(c(=o)oc)=coc4oc5(oc(c(c(c5o)o)o)co))
+** 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)
 * inchi-key:
-** xbamjztxgwptrm-awtfmmiesa-o
+** ctpqaxvnygzuaj-kxxvrosksa-d
 * molecular-weight:
-** 531.581
+** 569.977
 == Reaction(s) known to consume the compound ==
+* [[RXN-10963]]
+* [[RXN-13197]]
+* [[RXN-7163]]
 == Reaction(s) known to produce the compound ==
-* [[STRICTOSIDINE-SYNTHASE-RXN]]
+* [[2.7.1.134-RXN]]
+* [[2.7.1.140-RXN]]
+* [[RXN-10963]]
+* [[RXN-13197]]
+* [[RXN-7162]]
+* [[RXN-7184]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=3-&alpha;(s)-strictosidine}}
+{{#set: common-name=d-myo-inositol 1,3,4,5,6-pentakisphosphate}}
-{{#set: inchi-key=inchikey=xbamjztxgwptrm-awtfmmiesa-o}}
+{{#set: inchi-key=inchikey=ctpqaxvnygzuaj-kxxvrosksa-d}}
-{{#set: molecular-weight=531.581}}
+{{#set: molecular-weight=569.977}}