Difference between revisions of "CPD-458"

Revision as of 15:27, 5 January 2021

common-name:
- docosanoyl-coa
smiles:
- cccccccccccccccccccccc(=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:
- nddzlvocgalplr-gnsuaqhmsa-j
molecular-weight:
- 1086.076

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite EDTA ==
+== Metabolite CPD-10279 ==
 * common-name:
-** edta
+** docosanoyl-coa
 * smiles:
-** c(c[n+](cc([o-])=o)cc([o-])=o)[n+](cc([o-])=o)cc([o-])=o
+** cccccccccccccccccccccc(=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:
-** kcxvzyzypllwcc-uhfffaoysa-l
+** nddzlvocgalplr-gnsuaqhmsa-j
 * molecular-weight:
-** 290.229
+** 1086.076
 == Reaction(s) known to consume the compound ==
-* [[ExchangeSeed-EDTA]]
+* [[RXN-13297]]
-* [[TransportSeed-EDTA]]
 == Reaction(s) known to produce the compound ==
-* [[ExchangeSeed-EDTA]]
+* [[RXN-13307]]
-* [[TransportSeed-EDTA]]
+* [[TRANS-2-ENOYL-COA-REDUCTASE-NAD+-RXN-CPD-10279/NAD//CPD-14281/NADH/PROTON.37.]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=edta}}
+{{#set: common-name=docosanoyl-coa}}
-{{#set: inchi-key=inchikey=kcxvzyzypllwcc-uhfffaoysa-l}}
+{{#set: inchi-key=inchikey=nddzlvocgalplr-gnsuaqhmsa-j}}
-{{#set: molecular-weight=290.229}}
+{{#set: molecular-weight=1086.076}}