Difference between revisions of "C3"

Latest revision as of 19:36, 17 March 2021

common-name:
- udp-n-acetyl-α-d-muramoyl-l-alanyl-γ-d-glutamyl-l-lysyl-d-alanyl-d-alanine
molecular-weight:
- 1146.922
inchi-key:
- pfmvormcvgoqkr-xncokrrhsa-k
smiles:
- cc(c(=o)nc(c([o-])=o)c)nc(=o)c(cccc[n+])nc(=o)ccc(c(=o)[o-])nc(=o)c(c)nc(=o)c(c)oc1(c(o)c(co)oc(c(nc(=o)c)1)op(op(occ2(oc(c(o)c(o)2)n3(c=cc(=o)nc(=o)3)))([o-])=o)([o-])=o)

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite 2-ALPHA-HYDROXYETHYL-THPP ==
+== Metabolite C3 ==
 * common-name:
-** 2-(&alpha;-hydroxyethyl)thiamine diphosphate
+** udp-n-acetyl-&alpha;-d-muramoyl-l-alanyl-&gamma;-d-glutamyl-l-lysyl-d-alanyl-d-alanine
 * molecular-weight:
-** 466.341
+** 1146.922
 * inchi-key:
-** rruvjgasjonmdy-uhfffaoysa-l
+** pfmvormcvgoqkr-xncokrrhsa-k
 * smiles:
-** cc2(=c(sc(c(c)o)=[n+](cc1(c=nc(c)=nc(n)=1))2)ccop(=o)([o-])op(=o)([o-])[o-])
+** cc(c(=o)nc(c([o-])=o)c)nc(=o)c(cccc[n+])nc(=o)ccc(c(=o)[o-])nc(=o)c(c)nc(=o)c(c)oc1(c(o)c(co)oc(c(nc(=o)c)1)op(op(occ2(oc(c(o)c(o)2)n3(c=cc(=o)nc(=o)3)))([o-])=o)([o-])=o)
 == Reaction(s) known to consume the compound ==
-* [[RXN-12508]]
+* [[RXN-8975]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-12583]]
+* [[RXN-8975]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=2-(&alpha;-hydroxyethyl)thiamine diphosphate}}
+{{#set: common-name=udp-n-acetyl-&alpha;-d-muramoyl-l-alanyl-&gamma;-d-glutamyl-l-lysyl-d-alanyl-d-alanine}}
-{{#set: molecular-weight=466.341}}
+{{#set: molecular-weight=1146.922}}
-{{#set: inchi-key=inchikey=rruvjgasjonmdy-uhfffaoysa-l}}
+{{#set: inchi-key=inchikey=pfmvormcvgoqkr-xncokrrhsa-k}}