CHEBI:146183 - resibufagenin

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ChEBI Name resibufagenin
ChEBI ID CHEBI:146183
Definition A steroid lactone that has been used in the treatment of preeclampsia. A synthetic bufadienolide it is an antagonist of marinobufagenin (MBG) and differs from it by replacement of its 5β-OH and 13β-Me groups by hydrogen.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C23H30O4
Net Charge 0
Average Mass 370.489
Monoisotopic Mass 370.21441
InChI InChI=1S/C23H30O4/c1-22-9-8-15(24)10-14(22)3-4-19-18(22)6-5-17-16(11-20-23(17,19)27-20)13-2-7-21(25)26-12-13/h2,7,12,14-20,24H,3-6,8-11H2,1H3/t14-,15+,16-,17-,18+,19-,20-,22+,23-/m1/s1
InChIKey JOKJHYOPYWOZSU-GKQPMZOZSA-N
SMILES [C@]12(CC[C@@H](C[C@]2(CC[C@]3([C@]45[C@](CC[C@]13[H])([C@H](C[C@H]4O5)C6=COC(C=C6)=O)[H])[H])[H])O)C
ChEBI Ontology
Outgoing resibufagenin (CHEBI:146183) has functional parent bufanolide (CHEBI:22934)
resibufagenin (CHEBI:146183) is a epoxy steroid (CHEBI:145217)
resibufagenin (CHEBI:146183) is a steroid lactone (CHEBI:26766)
IUPAC Name
3β-hydroxy-5β,14β,15β-14,15:21,24-diepoxy-18-norchola-20,22-dien-24-one
Synonym Source
5-[(3β,5β,14β,15β,17β)-14,15-epoxy-3-hydroxy-10-methylgonan-17-yl]-2H-pyran-2-one ChEBI
Manual Xrefs Databases
CA2584151 Patent
EP1804789 Patent
US2008261928 Patent
US2010305079 Patent
WO2006044107 Patent
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Citations Waiting for Citations Types Sources
25545447 PubMed citation Europe PMC
31879340 PubMed citation Europe PMC
Last Modified
17 February 2020