Difference between revisions of "CPD-17312"

Latest revision as of 11:17, 18 March 2021

common-name:
- docosahexaenoyl-coa
smiles:
- ccc=ccc=ccc=ccc=ccc=ccc=cccc(=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:
- menfzxmqsyyvrk-crcgjgbysa-j
molecular-weight:
- 1073.981

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-8092 ==
+== Metabolite CPD-17312 ==
 * common-name:
-** 1-oleoyl-2-&alpha;-linolenoyl-phosphatidylcholine
+** docosahexaenoyl-coa
 * smiles:
-** ccccccccc=ccccccccc(occ(oc(=o)cccccccc=ccc=ccc=ccc)cop([o-])(=o)occ[n+](c)(c)c)=o
+** ccc=ccc=ccc=ccc=ccc=ccc=cccc(=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:
-** fvqgnfubhwgfcy-hjoyqdmmsa-n
+** menfzxmqsyyvrk-crcgjgbysa-j
 * molecular-weight:
-** 782.092
+** 1073.981
 == Reaction(s) known to consume the compound ==
-* [[RXN-8324]]
+* [[RXN-16063]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-8326]]
+* [[RXN-16063]]
+* [[RXN-16137]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=1-oleoyl-2-&alpha;-linolenoyl-phosphatidylcholine}}
+{{#set: common-name=docosahexaenoyl-coa}}
-{{#set: inchi-key=inchikey=fvqgnfubhwgfcy-hjoyqdmmsa-n}}
+{{#set: inchi-key=inchikey=menfzxmqsyyvrk-crcgjgbysa-j}}
-{{#set: molecular-weight=782.092}}
+{{#set: molecular-weight=1073.981}}