Difference between revisions of "CPD-17815"

Latest revision as of 11:12, 18 March 2021

common-name:
- (11z)-3-oxo-hexadecenoyl-coa
smiles:
- ccccc=ccccccccc(=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:
- lgtvdwicxibioi-ubpkjmqesa-j
molecular-weight:
- 1013.883

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite 3-HYDROXY-PROPIONYL-COA ==
+== Metabolite CPD-17815 ==
 * common-name:
-** 3-hydroxypropanoyl-coa
+** (11z)-3-oxo-hexadecenoyl-coa
 * smiles:
-** cc(c)(c(o)c(=o)nccc(=o)nccsc(cco)=o)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-]
+** ccccc=ccccccccc(=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:
-** berbfzcusmqabm-iexphmlfsa-j
+** lgtvdwicxibioi-ubpkjmqesa-j
 * molecular-weight:
-** 835.566
+** 1013.883
 == Reaction(s) known to consume the compound ==
-* [[HICH]]
+* [[RXN-16559]]
-* [[RXN-6383]]
-* [[RXN-6384]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-6383]]
+* [[RXN-16559]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=3-hydroxypropanoyl-coa}}
+{{#set: common-name=(11z)-3-oxo-hexadecenoyl-coa}}
-{{#set: inchi-key=inchikey=berbfzcusmqabm-iexphmlfsa-j}}
+{{#set: inchi-key=inchikey=lgtvdwicxibioi-ubpkjmqesa-j}}
-{{#set: molecular-weight=835.566}}
+{{#set: molecular-weight=1013.883}}