Difference between revisions of "CPD-690"

Latest revision as of 11:17, 18 March 2021

common-name:
- adenosyl-cobyrinate a,c-diamide
smiles:
- cc5(=c%10(c(c)(ccc([o-])=o)c(cc(=o)[o-])c9(c%11(c)(c(c)(cc(n)=o)c(ccc([o-])=o)c1(=[n+]([co--]3([n+]2(c(=c(c)1)c(c)(cc(n)=o)c(ccc([o-])=o)c=2c=c4(c(c)(c)c(ccc([o-])=o)c(=[n+]34)5)))(cc6(c(c(o)c(o6)n7(c=nc8(=c7n=cn=c8n)))o))n9%10)%11)))))
inchi-key:
- ocnljczkghkjgf-nqyrmhkhsa-h
molecular-weight:
- 1182.137

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-9866 ==
+== Metabolite CPD-690 ==
 * common-name:
-** 2-methoxy-6-(all-trans-nonaprenyl)phenol
+** adenosyl-cobyrinate a,c-diamide
 * smiles:
-** cc(=cccc(=cccc(=cccc(=cccc(=cccc(=cccc(=cccc(=cccc(=ccc1(c(o)=c(oc)c=cc=1))c)c)c)c)c)c)c)c)c
+** cc5(=c%10(c(c)(ccc([o-])=o)c(cc(=o)[o-])c9(c%11(c)(c(c)(cc(n)=o)c(ccc([o-])=o)c1(=[n+]([co--]3([n+]2(c(=c(c)1)c(c)(cc(n)=o)c(ccc([o-])=o)c=2c=c4(c(c)(c)c(ccc([o-])=o)c(=[n+]34)5)))(cc6(c(c(o)c(o6)n7(c=nc8(=c7n=cn=c8n)))o))n9%10)%11)))))
 * inchi-key:
-** xryxraoxvpwhhk-ssrazkmssa-n
+** ocnljczkghkjgf-nqyrmhkhsa-h
 * molecular-weight:
-** 737.203
+** 1182.137
 == Reaction(s) known to consume the compound ==
 == Reaction(s) known to produce the compound ==
-* [[RXN-9240]]
+* [[R344-RXN]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=2-methoxy-6-(all-trans-nonaprenyl)phenol}}
+{{#set: common-name=adenosyl-cobyrinate a,c-diamide}}
-{{#set: inchi-key=inchikey=xryxraoxvpwhhk-ssrazkmssa-n}}
+{{#set: inchi-key=inchikey=ocnljczkghkjgf-nqyrmhkhsa-h}}
-{{#set: molecular-weight=737.203}}
+{{#set: molecular-weight=1182.137}}