Difference between revisions of "SJ12399"

Revision as of 09:24, 27 August 2019

common-name:
- uroporphyrinogen-i
smiles:
- c(=o)([o-])ccc5(=c4(nc(cc1(nc(=c(cc([o-])=o)c(ccc(=o)[o-])=1)cc2(nc(=c(c(ccc(=o)[o-])=2)cc(=o)[o-])cc3(=c(ccc([o-])=o)c(cc(=o)[o-])=c(n3)c4))))=c(cc(=o)[o-])5))
inchi-key:
- qttnoskslatgqb-uhfffaoysa-f
molecular-weight:
- 828.742

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-934 CPD0-934] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11444 CPD-11444] ==
 * common-name:
-** glucosyl-(heptosyl)3-kdo2-lipid a-phosphate
+** uroporphyrinogen-i
 * smiles:
-** cccccccccccccc(=o)oc(cc(oc2(c(c(occ1(oc(op([o-])(=o)[o-])c(nc(=o)cc(o)ccccccccccc)c(oc(=o)cc(o)ccccccccccc)c(o)1))oc(c2op([o-])([o-])=o)coc8(c([o-])=o)(oc(c(o)co)c(oc6(oc(c(co)o)c(c(oc5(oc(c(coc3(oc(c(co)o)c(c(o)c3o)o))o)c(c(oc4(c(c(c(c(co)o4)o)o)o))c5o)o))c6o)op([o-])(=o)[o-]))c(oc7(c(=o)[o-])(oc(c(o)co)c(o)c(o)c7))c8))nc(cc(ccccccccccc)oc(ccccccccccc)=o)=o))=o)ccccccccccc
+** c(=o)([o-])ccc5(=c4(nc(cc1(nc(=c(cc([o-])=o)c(ccc(=o)[o-])=1)cc2(nc(=c(c(ccc(=o)[o-])=2)cc(=o)[o-])cc3(=c(ccc([o-])=o)c(cc(=o)[o-])=c(n3)c4))))=c(cc(=o)[o-])5))
 * inchi-key:
-** qhkuhequrqlsfa-jyysnnmzsa-f
+** qttnoskslatgqb-uhfffaoysa-f
 * molecular-weight:
-** 3049.306
+** 828.742
 == Reaction(s) known to consume the compound ==
-* [[RXN-14361]]
+* [[RXN-10642]]
 == Reaction(s) known to produce the compound ==
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=glucosyl-(heptosyl)3-kdo2-lipid a-phosphate}}
+{{#set: common-name=uroporphyrinogen-i}}
-{{#set: inchi-key=inchikey=qhkuhequrqlsfa-jyysnnmzsa-f}}
+{{#set: inchi-key=inchikey=qttnoskslatgqb-uhfffaoysa-f}}
-{{#set: molecular-weight=3049.306}}
+{{#set: molecular-weight=828.742}}