Difference between revisions of "CPD-15153"

Latest revision as of 11:17, 18 March 2021

common-name:
- 3-methyl-6-methoxy-2-octaprenyl-1,4-benzoquinone
smiles:
- cc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=ccc1(c(=o)c(oc)=cc(=o)c(c)=1)
inchi-key:
- flybtlrocqbhmr-kfsstaeesa-n
molecular-weight:
- 697.095

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-9894 ==
+== Metabolite CPD-15153 ==
 * common-name:
-** 3,4-dihydroxy-5-all-trans-octaprenylbenzoate
+** 3-methyl-6-methoxy-2-octaprenyl-1,4-benzoquinone
 * smiles:
-** cc(=cccc(=cccc(=cccc(=cccc(=cccc(=cccc(=cccc(=ccc1(=c(c(=cc(c([o-])=o)=c1)o)o))c)c)c)c)c)c)c)c
+** cc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=cccc(c)=ccc1(c(=o)c(oc)=cc(=o)c(c)=1)
 * inchi-key:
-** ztgcmypriiaxfd-lhsbzcsksa-m
+** flybtlrocqbhmr-kfsstaeesa-n
 * molecular-weight:
-** 698.06
+** 697.095
 == Reaction(s) known to consume the compound ==
-* [[RXN-9280]]
 == Reaction(s) known to produce the compound ==
+* [[RXN-14177]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=3,4-dihydroxy-5-all-trans-octaprenylbenzoate}}
+{{#set: common-name=3-methyl-6-methoxy-2-octaprenyl-1,4-benzoquinone}}
-{{#set: inchi-key=inchikey=ztgcmypriiaxfd-lhsbzcsksa-m}}
+{{#set: inchi-key=inchikey=flybtlrocqbhmr-kfsstaeesa-n}}
-{{#set: molecular-weight=698.06}}
+{{#set: molecular-weight=697.095}}