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digoxin

C41H64O14

Digoxin has the molecular formula C41H64O14 and a molar mass of 780.9 g/mol.

Properties

Molecular formulaC41H64O14
Molar mass780.9 g/mol
Exact (monoisotopic) mass780.42961 g/mol
logP (octanol–water)1.3
Topological polar surface area203 Ų
Hydrogen-bond donors / acceptors6 / 14
Heavy atoms55
InChIKeyLTMHDMANZUZIPE-PUGKRICDSA-N
IUPAC name3-[(3S,5R,8R,9S,10S,12R,13S,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-12,14-dihydroxy-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

Elemental composition

119 atoms across 3 elements, by mass.

ElementAtomsPercent by mass
Carbon (C)4163.06%
Oxygen (O)1428.68%
Hydrogen (H)648.26%

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Related compounds

Molar mass and elemental composition are computed from IUPAC 2021 conventional atomic weights. Formula, exact mass and the computed descriptors come from PubChem, which is US government work and in the public domain. Melting point, boiling point and density come from Wikidata under CC0. Properties with no figure shown are absent from those sources rather than zero.