Difference between revisions of "CPD-9854"

Revision as of 13:07, 14 January 2021

common-name:
- (s)-3-hydroxydecanoyl-coa
smiles:
- cccccccc(cc(sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(oc(c(c1op([o-])(=o)[o-])o)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-])=o)o
inchi-key:
- hivsmyzamunfkz-pnpvfpmqsa-j
molecular-weight:
- 933.753

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite 2-Me-Branched-234-Sat-FALD ==
+== Metabolite CPD0-2244 ==
 * common-name:
-** a 2-methyl branched 2,3,4-saturated fatty aldehyde
+** (s)-3-hydroxydecanoyl-coa
+* smiles:
+** cccccccc(cc(sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(oc(c(c1op([o-])(=o)[o-])o)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-])=o)o
+* inchi-key:
+** hivsmyzamunfkz-pnpvfpmqsa-j
+* molecular-weight:
+** 933.753
 == Reaction(s) known to consume the compound ==
-* [[RXN66-472]]
+* [[ECOAH4h]]
+* [[HACD4h]]
+* [[RXN-12490]]
 == Reaction(s) known to produce the compound ==
+* [[ECOAH4h]]
+* [[HACD4h]]
+* [[RXN-13616]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=a 2-methyl branched 2,3,4-saturated fatty aldehyde}}
+{{#set: common-name=(s)-3-hydroxydecanoyl-coa}}
+{{#set: inchi-key=inchikey=hivsmyzamunfkz-pnpvfpmqsa-j}}
+{{#set: molecular-weight=933.753}}