Difference between revisions of "CPD-10283"

Latest revision as of 11:14, 18 March 2021

common-name:
- 3-oxo-behenoyl-coa
smiles:
- cccccccccccccccccccc(=o)cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op([o-])(=o)occ1(c(op(=o)([o-])[o-])c(o)c(o1)n3(c=nc2(c(n)=nc=nc=23))))=o
inchi-key:
- rkcogguhkptoqj-gnsuaqhmsa-j
molecular-weight:
- 1100.059

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-8091 ==
+== Metabolite CPD-10283 ==
 * common-name:
-** 1-oleoyl-2-linoleoyl-phosphatidylcholine
+** 3-oxo-behenoyl-coa
 * smiles:
-** ccccccccc=ccccccccc(occ(oc(=o)cccccccc=ccc=cccccc)cop([o-])(=o)occ[n+](c)(c)c)=o
+** cccccccccccccccccccc(=o)cc(=o)sccnc(=o)ccnc(c(o)c(c)(c)cop([o-])(=o)op([o-])(=o)occ1(c(op(=o)([o-])[o-])c(o)c(o1)n3(c=nc2(c(n)=nc=nc=23))))=o
 * inchi-key:
-** gdwulugdxghjij-vjhnmzkjsa-n
+** rkcogguhkptoqj-gnsuaqhmsa-j
 * molecular-weight:
-** 784.107
+** 1100.059
 == Reaction(s) known to consume the compound ==
-* [[RXN-8322]]
+* [[RXN-13299]]
-* [[RXN-8326]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-8327]]
+* [[RXN-13295]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=1-oleoyl-2-linoleoyl-phosphatidylcholine}}
+{{#set: common-name=3-oxo-behenoyl-coa}}
-{{#set: inchi-key=inchikey=gdwulugdxghjij-vjhnmzkjsa-n}}
+{{#set: inchi-key=inchikey=rkcogguhkptoqj-gnsuaqhmsa-j}}
-{{#set: molecular-weight=784.107}}
+{{#set: molecular-weight=1100.059}}