Difference between revisions of "PWY-6013"

Revision as of 14:18, 26 August 2019

common-name:
- 4-trans-3-oxo-undecenoyl-coa
smiles:
- ccccccc=cc(=o)cc(=o)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-]
inchi-key:
- xbfqfvlnmjddng-dupkwvsksa-j
molecular-weight:
- 943.749

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18309 CPD-18309] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15678 CPD-15678] ==
 * common-name:
-** n-(r,r)-3-epoxysuccinamoyl-(s)-2,3-diaminopropanoyl-l-valine
+** 4-trans-3-oxo-undecenoyl-coa
 * smiles:
-** cc(c)c(c([o-])=o)nc(=o)c([n+])cnc(=o)c1(oc(c(=o)n)1)
+** ccccccc=cc(=o)cc(=o)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-]
 * inchi-key:
-** hcgfosjnuodeoh-rulnzfcnsa-n
+** xbfqfvlnmjddng-dupkwvsksa-j
 * molecular-weight:
-** 316.313
+** 943.749
 == Reaction(s) known to consume the compound ==
+* [[RXN-14793]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-16991]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=n-(r,r)-3-epoxysuccinamoyl-(s)-2,3-diaminopropanoyl-l-valine}}
+{{#set: common-name=4-trans-3-oxo-undecenoyl-coa}}
-{{#set: inchi-key=inchikey=hcgfosjnuodeoh-rulnzfcnsa-n}}
+{{#set: inchi-key=inchikey=xbfqfvlnmjddng-dupkwvsksa-j}}
-{{#set: molecular-weight=316.313}}
+{{#set: molecular-weight=943.749}}