Difference between revisions of "CPD-11519"

Latest revision as of 11:12, 18 March 2021

common-name:
- 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3r-hydroxyoctanoyl)-coa
smiles:
- ccc=ccc1(c(ccc(=o)1)cccccc(o)cc(sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ2(c(op([o-])(=o)[o-])c(o)c(o2)n4(c3(=c(c(n)=nc=n3)n=c4))))[o-])[o-])=o)
inchi-key:
- pddhcvxpabqiso-xjjfhseksa-j
molecular-weight:
- 1055.92

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite 2-C-METHYL-D-ERYTHRITOL-4-PHOSPHATE ==
+== Metabolite CPD-11519 ==
 * common-name:
-** 2-c-methyl-d-erythritol 4-phosphate
+** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3r-hydroxyoctanoyl)-coa
 * smiles:
-** cc(o)(co)c(o)cop([o-])([o-])=o
+** ccc=ccc1(c(ccc(=o)1)cccccc(o)cc(sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ2(c(op([o-])(=o)[o-])c(o)c(o2)n4(c3(=c(c(n)=nc=n3)n=c4))))[o-])[o-])=o)
 * inchi-key:
-** xmwhrvnvkdkbrg-uhnvwzdzsa-l
+** pddhcvxpabqiso-xjjfhseksa-j
 * molecular-weight:
-** 214.111
+** 1055.92
 == Reaction(s) known to consume the compound ==
-* [[2.7.7.60-RXN]]
+* [[RXN-10698]]
-* [[DXPREDISOM-RXN]]
 == Reaction(s) known to produce the compound ==
-* [[DXPREDISOM-RXN]]
+* [[RXN-10697]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=2-c-methyl-d-erythritol 4-phosphate}}
+{{#set: common-name=3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3r-hydroxyoctanoyl)-coa}}
-{{#set: inchi-key=inchikey=xmwhrvnvkdkbrg-uhnvwzdzsa-l}}
+{{#set: inchi-key=inchikey=pddhcvxpabqiso-xjjfhseksa-j}}
-{{#set: molecular-weight=214.111}}
+{{#set: molecular-weight=1055.92}}