CHEBI:59028 - acetylstrophanthidin

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ChEBI Name acetylstrophanthidin
ChEBI ID CHEBI:59028
Definition An acetate ester that is strophanidin acetylated at the 3β-hydroxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C25H34O7
Net Charge 0
Average Mass 446.53330
Monoisotopic Mass 446.23045
InChI InChI=1S/C25H34O7/c1-15(27)32-17-3-8-23(14-26)19-4-7-22(2)18(16-11-21(28)31-13-16)6-10-25(22,30)20(19)5-9-24(23,29)12-17/h11,14,17-20,29-30H,3-10,12-13H2,1-2H3/t17-,18+,19-,20+,22+,23-,24-,25-/m0/s1
InChIKey JLZAERUVCODZQO-VWCUIIQSSA-N
SMILES [H][C@@]1(CC[C@]2(O)[C@]3([H])CC[C@]4(O)C[C@H](CC[C@]4(C=O)[C@@]3([H])CC[C@]12C)OC(C)=O)C1=CC(=O)OC1
Roles Classification
Application(s): anti-arrhythmia drug
A drug used for the treatment or prevention of cardiac arrhythmias. Anti-arrhythmia drugs may affect the polarisation-repolarisation phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibres.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing acetylstrophanthidin (CHEBI:59028) has functional parent strophanthidin (CHEBI:38178)
acetylstrophanthidin (CHEBI:59028) has role anti-arrhythmia drug (CHEBI:38070)
acetylstrophanthidin (CHEBI:59028) is a acetate ester (CHEBI:47622)
IUPAC Name
3β-acetyloxy-5,14-dihydroxy-19-oxo-5β-card-20(22)-enolide
Synonyms Sources
3β,5,14-trihydroxy-19-oxo-5β-card-20(22)-enolide 3-acetate ChemIDplus
3β-acetoxy-5,14-dihydroxy-19-oxo-5β-card-20(22)-enolide IUPAC
Acetyl-k-strophanthidine ChEBI
acetyl-strophanthidin ChEBI
Erysimupicrone acetate ChemIDplus
Strophanthidin 3-acetate ChemIDplus
Strophanthidin acetate ChemIDplus
Registry Numbers Types Sources
60-38-8 CAS Registry Number ChemIDplus
99776 Reaxys Registry Number Reaxys
99776 Beilstein Registry Number Beilstein
Citations Waiting for Citations Types Sources
10438974 PubMed citation Europe PMC
6494234 PubMed citation Europe PMC
7140138 PubMed citation Europe PMC
8225670 PubMed citation Europe PMC
Last Modified
27 November 2015