Difference between revisions of "CPD-17263"

Latest revision as of 11:12, 18 March 2021

common-name:
- (8z,11z,14z,17z)-3-hydroxy-icosa-8,11,14,17-tetraenoyl-coa
smiles:
- ccc=ccc=ccc=ccc=cccccc(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:
- pcgphlmaazkqfq-fpxdaddusa-j
molecular-weight:
- 1065.958

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CATECHOL ==
+== Metabolite CPD-17263 ==
 * common-name:
-** catechol
+** (8z,11z,14z,17z)-3-hydroxy-icosa-8,11,14,17-tetraenoyl-coa
 * smiles:
-** c1(c=cc(=c(c=1)o)o)
+** ccc=ccc=ccc=ccc=cccccc(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:
-** ycimnllnpgfghc-uhfffaoysa-n
+** pcgphlmaazkqfq-fpxdaddusa-j
 * molecular-weight:
-** 110.112
+** 1065.958
 == Reaction(s) known to consume the compound ==
+* [[RXN-16021]]
 == Reaction(s) known to produce the compound ==
-* [[1.3.1.20-RXN]]
+* [[RXN-16020]]
-* [[RXN-3661]]
-* [[SALICYLATE-1-MONOOXYGENASE-RXN]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=catechol}}
+{{#set: common-name=(8z,11z,14z,17z)-3-hydroxy-icosa-8,11,14,17-tetraenoyl-coa}}
-{{#set: inchi-key=inchikey=ycimnllnpgfghc-uhfffaoysa-n}}
+{{#set: inchi-key=inchikey=pcgphlmaazkqfq-fpxdaddusa-j}}
-{{#set: molecular-weight=110.112}}
+{{#set: molecular-weight=1065.958}}