Difference between revisions of "CPD-11525"

Latest revision as of 11:13, 18 March 2021

common-name:
- 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-butanoyl-coa
smiles:
- ccc=ccc1(c(ccc(=o)1)cccc(=o)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-])
inchi-key:
- yyuzysvpfvoylb-rguwmiccsa-j
molecular-weight:
- 983.813

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD1F-137 ==
+== Metabolite CPD-11525 ==
 * common-name:
-** gibberellin a4
+** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-butanoyl-coa
 * smiles:
-** c=c1(c3(cc4(c1)(c([ch]5(c2(c(=o)oc(ccc(o)2)([ch](cc3)4)5)(c)))c([o-])=o)))
+** ccc=ccc1(c(ccc(=o)1)cccc(=o)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-])
 * inchi-key:
-** rsqsqjnrhicnnh-ukjriftcsa-m
+** yyuzysvpfvoylb-rguwmiccsa-j
 * molecular-weight:
-** 331.388
+** 983.813
 == Reaction(s) known to consume the compound ==
-* [[RXN-6550]]
+* [[RXN-10707]]
 == Reaction(s) known to produce the compound ==
-* [[RXN1F-165]]
+* [[RXN-10700]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=gibberellin a4}}
+{{#set: common-name=3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-butanoyl-coa}}
-{{#set: inchi-key=inchikey=rsqsqjnrhicnnh-ukjriftcsa-m}}
+{{#set: inchi-key=inchikey=yyuzysvpfvoylb-rguwmiccsa-j}}
-{{#set: molecular-weight=331.388}}
+{{#set: molecular-weight=983.813}}