Difference between revisions of "CPD-4822"

Latest revision as of 11:14, 18 March 2021

common-name:
- kanamycin b
smiles:
- c([n+])c1(c(o)c(o)c([n+])c(o1)oc2(c([n+])cc(c(c2o)oc3(oc(co)c(o)c([n+])c(o)3))[n+]))
inchi-key:
- skklouvuunmcje-fqsmhnglsa-s
molecular-weight:
- 488.557

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-18493 ==
+== Metabolite CPD-4822 ==
 * common-name:
-** (3s)-hydroxy-(6z,9z,12z,15z,18z)-tetracosapentaenoyl-coa
+** kanamycin b
 * smiles:
-** cccccc=ccc=ccc=ccc=ccc=cccc(o)cc(sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-])=o
+** c([n+])c1(c(o)c(o)c([n+])c(o1)oc2(c([n+])cc(c(c2o)oc3(oc(co)c(o)c([n+])c(o)3))[n+]))
 * inchi-key:
-** nneppynerzejee-vugypbmhsa-j
+** skklouvuunmcje-fqsmhnglsa-s
 * molecular-weight:
-** 1120.05
+** 488.557
 == Reaction(s) known to consume the compound ==
+* [[RXN-14553]]
+* [[RXN-15287]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-17114]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=(3s)-hydroxy-(6z,9z,12z,15z,18z)-tetracosapentaenoyl-coa}}
+{{#set: common-name=kanamycin b}}
-{{#set: inchi-key=inchikey=nneppynerzejee-vugypbmhsa-j}}
+{{#set: inchi-key=inchikey=skklouvuunmcje-fqsmhnglsa-s}}
-{{#set: molecular-weight=1120.05}}
+{{#set: molecular-weight=488.557}}