Difference between revisions of "CPD-9088"

Latest revision as of 11:12, 18 March 2021

smiles:
- ccc5(c(c)c9(n6([mg]27(n1(c(c(c)c(ccc(=o)occ=c(c)ccc=c(c)ccc=c(c)ccc=c(c)c)c=1c4([c-](c(oc)=o)c(=o)c3(=c(c)c(n2c3=4)=cc5=6)))=cc8(=c(c)c(c(c)=o)=c(n78)c=9))))))
common-name:
- geranylgeranyl bacteriochlorophyllide a
molecular-weight:
- 904.462

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite OBTUSIFOLIOL ==
+== Metabolite CPD-9088 ==
+* smiles:
+** ccc5(c(c)c9(n6([mg]27(n1(c(c(c)c(ccc(=o)occ=c(c)ccc=c(c)ccc=c(c)ccc=c(c)c)c=1c4([c-](c(oc)=o)c(=o)c3(=c(c)c(n2c3=4)=cc5=6)))=cc8(=c(c)c(c(c)=o)=c(n78)c=9))))))
 * common-name:
-** obtusifoliol
+** geranylgeranyl bacteriochlorophyllide a
-* smiles:
-** cc(c)c(=c)ccc(c)[ch]3(ccc4(c)(c2(cc[ch]1(c(c)c(o)ccc(c)1c=2ccc(c)34))))
-* inchi-key:
-** mmnykqidrznikt-vsadubdnsa-n
 * molecular-weight:
-** 426.724
+** 904.462
 == Reaction(s) known to consume the compound ==
-* [[1.14.13.70-RXN]]
+* [[RXN-17426]]
+* [[RXN-8789]]
 == Reaction(s) known to produce the compound ==
-* [[CYCLOEUCALENOL-CYCLOISOMERASE-RXN]]
+* [[RXN-8788]]
+* [[RXN-8789]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=obtusifoliol}}
+{{#set: common-name=geranylgeranyl bacteriochlorophyllide a}}
-{{#set: inchi-key=inchikey=mmnykqidrznikt-vsadubdnsa-n}}
+{{#set: molecular-weight=904.462}}
-{{#set: molecular-weight=426.724}}