Difference between revisions of "CPD-19154"

Revision as of 11:16, 15 January 2021

common-name:
- 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3r-hydroxybutanoyl)-coa
smiles:
- ccc=ccc1(c(ccc(=o)1)cc(o)cc(=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:
- yufhotsrmdfgns-gbypgrtbsa-j
molecular-weight:
- 999.813

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD1F-120 ==
+== Metabolite CPD-11527 ==
 * common-name:
-** gibberellin a24
+** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3r-hydroxybutanoyl)-coa
 * smiles:
-** c=c1(c2(cc3(c1)(c([ch]4(c(c)(cccc(c=o)([ch](cc2)3)4)c([o-])=o))c([o-])=o)))
+** ccc=ccc1(c(ccc(=o)1)cc(o)cc(=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:
-** qqrsshfhxysomf-cxxojbqzsa-l
+** yufhotsrmdfgns-gbypgrtbsa-j
 * molecular-weight:
-** 344.407
+** 999.813
 == Reaction(s) known to consume the compound ==
+* [[RXN-10703]]
 == Reaction(s) known to produce the compound ==
-* [[RXN1F-163]]
+* [[RXN-10705]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=gibberellin a24}}
+{{#set: common-name=3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3r-hydroxybutanoyl)-coa}}
-{{#set: inchi-key=inchikey=qqrsshfhxysomf-cxxojbqzsa-l}}
+{{#set: inchi-key=inchikey=yufhotsrmdfgns-gbypgrtbsa-j}}
-{{#set: molecular-weight=344.407}}
+{{#set: molecular-weight=999.813}}