Difference between revisions of "CPD-11975"

Latest revision as of 11:14, 18 March 2021

common-name:
- 1-o-(2-acetamido-2-deoxy-α-d-glucopyranosyl)-1d-myo-inositol 3-phosphate
smiles:
- cc(=o)nc2(c(oc1(c(o)c(o)c(o)c(op([o-])(=o)[o-])c(o)1))oc(c(c2o)o)co)
inchi-key:
- chttvmdqgbocme-dnswdbfxsa-l
molecular-weight:
- 461.316

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite ADENOSINE5TRIPHOSPHO5ADENOSINE ==
+== Metabolite CPD-11975 ==
 * common-name:
-** 5',5'''-diadenosine triphosphate
+** 1-o-(2-acetamido-2-deoxy-&alpha;-d-glucopyranosyl)-1d-myo-inositol 3-phosphate
 * smiles:
-** c(c3(c(c(c(n2(c1(=c(c(=nc=n1)n)n=c2)))o3)o)o))op(=o)([o-])op(=o)([o-])op(=o)([o-])occ6(c(c(c(n5(c4(=c(c(=nc=n4)n)n=c5)))o6)o)o)
+** cc(=o)nc2(c(oc1(c(o)c(o)c(o)c(op([o-])(=o)[o-])c(o)1))oc(c(c2o)o)co)
 * inchi-key:
-** qcicupzzliqapa-xpwfqurosa-k
+** chttvmdqgbocme-dnswdbfxsa-l
 * molecular-weight:
-** 753.388
+** 461.316
 == Reaction(s) known to consume the compound ==
-* [[BIS5-ADENOSYL-TRIPHOSPHATASE-RXN]]
 == Reaction(s) known to produce the compound ==
+* [[RXN-6501]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=5',5'''-diadenosine triphosphate}}
+{{#set: common-name=1-o-(2-acetamido-2-deoxy-&alpha;-d-glucopyranosyl)-1d-myo-inositol 3-phosphate}}
-{{#set: inchi-key=inchikey=qcicupzzliqapa-xpwfqurosa-k}}
+{{#set: inchi-key=inchikey=chttvmdqgbocme-dnswdbfxsa-l}}
-{{#set: molecular-weight=753.388}}
+{{#set: molecular-weight=461.316}}