Difference between revisions of "CPD-14277"

Latest revision as of 11:11, 18 March 2021

common-name:
- (3r)-3-hydroxy-lignoceroyl-coa
smiles:
- cccccccccccccccccccccc(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:
- qibkbvrvofikln-ysowjfsksa-j
molecular-weight:
- 1130.129

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-17638 ==
+== Metabolite CPD-14277 ==
 * common-name:
-** 7-hydroxylauroyl-coa
+** (3r)-3-hydroxy-lignoceroyl-coa
 * smiles:
-** cccccc(o)cccccc(=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-]
+** cccccccccccccccccccccc(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:
-** rxedusgpuqqzew-xirpngcasa-j
+** qibkbvrvofikln-ysowjfsksa-j
 * molecular-weight:
-** 961.807
+** 1130.129
 == Reaction(s) known to consume the compound ==
+* [[RXN-13304]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-12184]]
+* [[RXN-13300]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=7-hydroxylauroyl-coa}}
+{{#set: common-name=(3r)-3-hydroxy-lignoceroyl-coa}}
-{{#set: inchi-key=inchikey=rxedusgpuqqzew-xirpngcasa-j}}
+{{#set: inchi-key=inchikey=qibkbvrvofikln-ysowjfsksa-j}}
-{{#set: molecular-weight=961.807}}
+{{#set: molecular-weight=1130.129}}