Difference between revisions of "CPD-665"

Latest revision as of 11:14, 18 March 2021

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-22095 ==
+== Metabolite CPD-665 ==
 * common-name:
-** fucosterol
+** 1-propanal
+* smiles:
+** cc[ch]=o
 * inchi-key:
-** oselkochbmdkej-jugjngjrsa-n
+** nbbjymsmwiiqgu-uhfffaoysa-n
 * molecular-weight:
-** 412.698
+** 58.08
-* smiles:
-** cc=c(c(c)c)cc[c@@h](c)[c@@h]3(cc[c@@h]4([c@h]2(cc=c1(c[c@@h](o)cc[c@@](c)1[c@h]2cc[c@](c)34))))
 == Reaction(s) known to consume the compound ==
+* [[RXN-13198]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-22198]]
+* [[RXN-13198]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=fucosterol}}
+{{#set: common-name=1-propanal}}
-{{#set: inchi-key=inchikey=oselkochbmdkej-jugjngjrsa-n}}
+{{#set: inchi-key=inchikey=nbbjymsmwiiqgu-uhfffaoysa-n}}
-{{#set: molecular-weight=412.698}}
+{{#set: molecular-weight=58.08}}