Difference between revisions of "CPD-17367"

Latest revision as of 11:17, 18 March 2021

common-name:
- (3r)-hydroxy-adrenoyl-coa
smiles:
- cccccc=ccc=ccc=ccc=ccccc(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:
- jhxlrlhtjymvbk-dhdhvehbsa-j
molecular-weight:
- 1094.012

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-10244 ==
+== Metabolite CPD-17367 ==
 * common-name:
-** docosahexaenoate
+** (3r)-hydroxy-adrenoyl-coa
 * smiles:
-** ccc=ccc=ccc=ccc=ccc=ccc=cccc(=o)[o-]
+** cccccc=ccc=ccc=ccc=ccccc(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:
-** mbmbgcfofbjsgt-kubavdmbsa-m
+** jhxlrlhtjymvbk-dhdhvehbsa-j
 * molecular-weight:
-** 327.486
+** 1094.012
 == Reaction(s) known to consume the compound ==
-* [[RXN-16063]]
+* [[RXN-16113]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-16017]]
+* [[RXN-16112]]
-* [[RXN-16063]]
-* [[RXN-16138]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=docosahexaenoate}}
+{{#set: common-name=(3r)-hydroxy-adrenoyl-coa}}
-{{#set: inchi-key=inchikey=mbmbgcfofbjsgt-kubavdmbsa-m}}
+{{#set: inchi-key=inchikey=jhxlrlhtjymvbk-dhdhvehbsa-j}}
-{{#set: molecular-weight=327.486}}
+{{#set: molecular-weight=1094.012}}