Difference between revisions of "CPD-15436"

Latest revision as of 11:13, 18 March 2021

common-name:
- (5z)-tetradecenoyl-coa
smiles:
- ccccccccc=ccccc(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
inchi-key:
- mrvdzohjmltlhj-stfckwfxsa-j
molecular-weight:
- 971.845

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-1137 ==
+== Metabolite CPD-15436 ==
 * common-name:
-** itaconyl-coa
+** (5z)-tetradecenoyl-coa
 * smiles:
-** c=c(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([o-])=o
+** ccccccccc=ccccc(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
 * inchi-key:
-** nfvgylgssjprkw-citakdkdsa-i
+** mrvdzohjmltlhj-stfckwfxsa-j
 * molecular-weight:
-** 874.579
+** 971.845
 == Reaction(s) known to consume the compound ==
+* [[RXN-14576]]
+* [[RXN-17783]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-8988]]
+* [[RXN-17782]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=itaconyl-coa}}
+{{#set: common-name=(5z)-tetradecenoyl-coa}}
-{{#set: inchi-key=inchikey=nfvgylgssjprkw-citakdkdsa-i}}
+{{#set: inchi-key=inchikey=mrvdzohjmltlhj-stfckwfxsa-j}}
-{{#set: molecular-weight=874.579}}
+{{#set: molecular-weight=971.845}}