Digitoxin
- IUPAC name
- 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
- Molecular formula
- C41H64O13
- Molecular weight
- 764.9 g/mol
- Exact mass
- 764.43469209 Da
- XLogP3
- 2.3
- Topological polar surface area
- 183.0 Ų
- Hydrogen-bond donors
- 5
- Hydrogen-bond acceptors
- 13
- Covalent units
- 1
- Defined stereocentres
- 20
Also known as
16 more reported names
External database identifiers
- ChEBI:CHEBI:28544
- ChEMBL:CHEMBL254219
- EPA DTXSID:DTXSID0022933
- PubMed:24275119
- PubMed:21763352
- PubMed:11525233
- PubMed:11515708
- PubMed:11395576
- PubMed:8421289
- PubMed:1469187
Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.