Difference between revisions of "CPD-514"

Latest revision as of 19:33, 17 March 2021

common-name:
- 3-oxo-3-phenylpropanoyl-coa
molecular-weight:
- 909.648
inchi-key:
- nhdpiyiccbknnj-fueukbnzsa-j
smiles:
- cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc(=o)c1(=cc=cc=c1))cop(=o)(op(=o)(occ2(c(op([o-])(=o)[o-])c(o)c(o2)n4(c3(=c(c(n)=nc=n3)n=c4))))[o-])[o-]

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite GDP-TP ==
+== Metabolite CPD-514 ==
 * common-name:
-** pppgpp
+** 3-oxo-3-phenylpropanoyl-coa
 * molecular-weight:
-** 677.095
+** 909.648
 * inchi-key:
-** kcpmacxzaitqax-uuokfmhzsa-h
+** nhdpiyiccbknnj-fueukbnzsa-j
 * smiles:
-** c(op([o-])(=o)op([o-])(=o)op([o-])(=o)[o-])c1(oc(c(o)c(op([o-])(=o)op(o)([o-])=o)1)n3(c=nc2(c(=o)nc(n)=nc=23)))
+** cc(c)(c(o)c(=o)nccc(=o)nccsc(=o)cc(=o)c1(=cc=cc=c1))cop(=o)(op(=o)(occ2(c(op([o-])(=o)[o-])c(o)c(o2)n4(c3(=c(c(n)=nc=n3)n=c4))))[o-])[o-]
 == Reaction(s) known to consume the compound ==
+* [[RXN-2006]]
 == Reaction(s) known to produce the compound ==
-* [[GTPPYPHOSKIN-RXN]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=pppgpp}}
+{{#set: common-name=3-oxo-3-phenylpropanoyl-coa}}
-{{#set: molecular-weight=677.095}}
+{{#set: molecular-weight=909.648}}
-{{#set: inchi-key=inchikey=kcpmacxzaitqax-uuokfmhzsa-h}}
+{{#set: inchi-key=inchikey=nhdpiyiccbknnj-fueukbnzsa-j}}