Difference between revisions of "CPD-15676"

Latest revision as of 11:11, 18 March 2021

common-name:
- 6-trans-3-oxo-tridecenoyl-coa
smiles:
- ccccccc=cccc(=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:
- fdxhxlpclxeysu-hmxwsvnbsa-j
molecular-weight:
- 971.802

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite 1-2-DIPALMITOYLPHOSPHATIDYLCHOLINE ==
+== Metabolite CPD-15676 ==
 * common-name:
-** 1,2-dipalmitoyl-phosphatidylcholine
+** 6-trans-3-oxo-tridecenoyl-coa
 * smiles:
-** cccccccccccccccc(occ(oc(=o)ccccccccccccccc)cop(occ[n+](c)(c)c)([o-])=o)=o
+** ccccccc=cccc(=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:
-** kilnvbdswzsgll-kxqooqhdsa-n
+** fdxhxlpclxeysu-hmxwsvnbsa-j
 * molecular-weight:
-** 734.048
+** 971.802
 == Reaction(s) known to consume the compound ==
-* [[RXN-15065]]
+* [[RXN-14788]]
-* [[RXN-15066]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-15066]]
-* [[RXN66-578]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=1,2-dipalmitoyl-phosphatidylcholine}}
+{{#set: common-name=6-trans-3-oxo-tridecenoyl-coa}}
-{{#set: inchi-key=inchikey=kilnvbdswzsgll-kxqooqhdsa-n}}
+{{#set: inchi-key=inchikey=fdxhxlpclxeysu-hmxwsvnbsa-j}}
-{{#set: molecular-weight=734.048}}
+{{#set: molecular-weight=971.802}}