Difference between revisions of "CPD-10576"

Revision as of 14:54, 5 January 2021

common-name:
- 24-ethylidenelophenol
smiles:
- cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4(c2(=cc[ch]1(c(c)c(o)ccc(c)1[ch]2ccc(c)34))))
inchi-key:
- lpzccmiisibrei-jxmpmkkesa-n
molecular-weight:
- 426.724

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite COBINAMIDE ==
+== Metabolite CPD-4124 ==
 * common-name:
-** cobinamide
+** 24-ethylidenelophenol
 * smiles:
-** cc(o)cnc(=o)ccc5(c)(c(cc(=o)n)[ch]7(c8(c)(c(c)(cc(n)=o)c(ccc(n)=o)c1(=[n+]([co---]26([n+]4(c(=cc3(c(ccc(n)=o)c(c)(cc(n)=o)c(=c(c)1)[n+]2=3))c(c)(c)c(ccc(n)=o)c=4c(c)=c5n67)))8))))
+** cc=c(c(c)c)ccc(c)[ch]3(cc[ch]4(c2(=cc[ch]1(c(c)c(o)ccc(c)1[ch]2ccc(c)34))))
 * inchi-key:
-** xqrjfevdqxeiax-jfyqdrlcsa-m
+** lpzccmiisibrei-jxmpmkkesa-n
 * molecular-weight:
-** 990.096
+** 426.724
 == Reaction(s) known to consume the compound ==
-* [[BTUR2-RXN]]
+* [[RXN-4208-CPD-4124/DIMETHYL-GLYCINE//CPD-4125/BETAINE.44.]]
 == Reaction(s) known to produce the compound ==
+* [[2.1.1.143-RXN]]
+* [[RXN-4208-CPD-4124/DIMETHYL-GLYCINE//CPD-4125/BETAINE.44.]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=cobinamide}}
+{{#set: common-name=24-ethylidenelophenol}}
-{{#set: inchi-key=inchikey=xqrjfevdqxeiax-jfyqdrlcsa-m}}
+{{#set: inchi-key=inchikey=lpzccmiisibrei-jxmpmkkesa-n}}
-{{#set: molecular-weight=990.096}}
+{{#set: molecular-weight=426.724}}