Difference between revisions of "CPD-665"

Revision as of 15:27, 5 January 2021

common-name:
- gibberellin a19
smiles:
- c=c1(c2(o)(cc3(c1)(c([ch]4(c(c)(cccc(c=o)([ch](cc2)3)4)c([o-])=o))c([o-])=o)))
inchi-key:
- vncqcpqamdqeby-ytjhipewsa-l
molecular-weight:
- 360.406

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-22095 ==
+== Metabolite CPD1F-96 ==
 * common-name:
-** fucosterol
+** gibberellin a19
+* smiles:
+** c=c1(c2(o)(cc3(c1)(c([ch]4(c(c)(cccc(c=o)([ch](cc2)3)4)c([o-])=o))c([o-])=o)))
 * inchi-key:
-** oselkochbmdkej-jugjngjrsa-n
+** vncqcpqamdqeby-ytjhipewsa-l
 * molecular-weight:
-** 412.698
+** 360.406
-* 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 ==
 == Reaction(s) known to produce the compound ==
-* [[RXN-22198]]
+* [[RXN1F-168]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=fucosterol}}
+{{#set: common-name=gibberellin a19}}
-{{#set: inchi-key=inchikey=oselkochbmdkej-jugjngjrsa-n}}
+{{#set: inchi-key=inchikey=vncqcpqamdqeby-ytjhipewsa-l}}
-{{#set: molecular-weight=412.698}}
+{{#set: molecular-weight=360.406}}