洋地黄毒素

Description

Digitoxin · CAS 71-63-6 · C41H64O13.

Identification

CAS Registry Number	71-63-6
PubChem CID	3061
Molecular formula	C41H64O13
IUPAC name	3-[3-[5-[5-(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

Computed Descriptors

Molecular Weight	764.9
XLogP3	2.3
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	13
Rotatable Bond Count	7
Exact Mass	764.43469209
Monoisotopic Mass	764.43469209
Topological Polar Surface Area	183
Heavy Atom Count	54
Formal Charge	0

Documented Uses

• Agents used for the treatment or prevention of cardiac arrhythmias. They may affect the polarization-repolarization phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibers. Anti-arrhythmia agents are often classed into four main groups according to their mechanism of action: sodium channel blockade, beta-adrenergic blockade, repolarization prolongation, or calcium channel blockade.
• Agents that have a strengthening effect on the heart or that can increase cardiac output. They may be CARDIAC GLYCOSIDES; SYMPATHOMIMETICS; or other drugs. They are used after MYOCARDIAL INFARCT; CARDIAC SURGICAL PROCEDURES; in SHOCK; or in congestive heart failure (HEART FAILURE).
• Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction.

Synonyms

Digimed; RefChem:920185; Natigal; De-Tone; Purodigin, crystalline; Acedoxin; Coramedan; Digoxin EP Impurity A; NSC 7529; MFCD00003686; NCGC00159428-02; CHEMBL267817; WDJUZGPOPHTGOT-UHFFFAOYSA-N; NCGC00159428-03; NCI60_041649; DB-055556

Frequently Asked Questions

What are the CAS number and molecular formula of Digitoxin?

CAS 71-63-6; molecular formula C41H64O13; molecular weight — g/mol.

What other names is Digitoxin known by?

Digimed, RefChem:920185, Natigal, De-Tone, Purodigin, crystalline, Acedoxin.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.