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Basic Information
CAS No.: 17575-20-1
Name: LANATOSIDE A
Molecular Structure:
Molecular Structure of 17575-20-1 (LANATOSIDE A)
Formula: C49H76 O19
Molecular Weight: 969.131
Synonyms: 5b-Card-20(22)-enolide, 3b-[[O-[O-(O-glucosyldigitoxosyl)digitoxosyl]digitoxosyl]oxy]-14-hydroxy-,acetate (7CI); Lanatoside A (6CI,8CI); Adigal; Digilanide A; NSC 7532
Density: 1.39g/cm3
Melting Point: 245-248°C
Boiling Point: °Cat760mmHg
Flash Point: °C
Safety: A deadly poison by ingestion, intraperitoneal, and intravenous routes. When heated to decomposition it emits acrid smoke and irritating fumes.
PSA: 268.05000
LogP: 1.64230
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Chemistry

IUPAC:  [6-[4-Hydroxy-6-[4-hydroxy-6-[[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6, 7,8,9, 11, 12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyloxan-3-yl]oxy-2-methyloxan-3-yl]oxy-2-methyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl] acetate
  Lanatoside A with CAS NO.of 17575-20-1 is also called for 3-((O-beta-D-Glucopyranosyl-(1-4)-O-3-O-acetyl-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy)-14-hydroxycard-20(22)-enolide (3beta,5beta)- ; 5-18-03-00355 (Beilstein Handbook Reference) ; Adigal ; BRN 0078336 ; Digilanid A ; Digilanide A ; Digitoxigenin + 2 digitoxose + acetyl-digilanidobose ; EINECS 241-544-0 ; Lanatosid A ; NSC 7532 ; Card-20(22)-enolide, 3-((O-beta-D-glucopyranosyl-(1-4)-O-3-O-acetyl-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy)-14-hydroxy-, (3beta,5beta)- (9CI) and so on.
CAS: 17575-20-1
Molecular Formula: C49H76O19
Molecular Weight: 969.12
EINECS: 241-544-0
ACD/LogP: 0.96 
ACD/LogD (pH 5.5): 0.96 
ACD/LogD (pH 7.4): 0.96 
ACD/BCF (pH 5.5): 3.15 
ACD/BCF (pH 7.4): 3.15 
ACD/KOC (pH 5.5): 79.12 
ACD/KOC (pH 7.4): 79.12 
H bond acceptors: 19 
H bond donors: 7 
Freely Rotating Bonds: 19
Heavy Atom Count: 68
Formal Charge: 0
Complexity: 1840
Isotope Atom Count: 0
Defined Atom StereoCenter Count: 0
Undefined Atom StereoCenter Count: 25
Defined Bond StereoCenter Count: 0
Undefined Bond StereoCenter Count: 0
Covalently-Bonded Unit Count: 1  
Index of Refraction: 1.601 
Molar Refractivity: 238.17 cm3 
Molar Volume: 694.9 cm3   
Surface Tension: 67 dyne/cm 
Density: 1.39 g/cm3
The molecular structure of  Lanatoside A with CAS NO.of 17575-20-1:

Uses

 Lanatoside A (CAS NO.17575-20-1) is used to  treat congestive heart failure and a variety of rapid supraventricular arrhythmia.

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo intravenous 220ug/kg (0.22mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 184, Pg. 181, 1937.
guinea pig LD50 oral 100mg/kg (100mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 15, Pg. 481, 1965.
guinea pig LDLo intravenous 1040ug/kg (1.04mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 18, Pg. 311, 1962.
mouse LD50 intracrebral 32ug/kg (0.032mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Arzneimittel-Forschung. Drug Research. Vol. 11, Pg. 908, 1961.
mouse LD50 intraperitoneal 20mg/kg (20mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 155, Pg. 165, 1965.
mouse LD50 intravenous 21300ug/kg (21.3mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Arzneimittel-Forschung. Drug Research. Vol. 11, Pg. 908, 1961.
mouse LD50 oral 9340ug/kg (9.34mg/kg)   Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 54, Pg. 58, 1958.
rat LD50 intravenous 16mg/kg (16mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 155, Pg. 165, 1965.

Safety Profile

A deadly poison by ingestion, intraperitoneal, and intravenous routes. When heated to decomposition it emits acrid smoke and irritating fumes.