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| CAS No.: | 17575-22-3 |
|---|---|
| Name: | LANATOSIDE C |
| Molecular Structure: | |
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| Formula: | C49H76 O20 |
| Molecular Weight: | 985.13 |
| Synonyms: | LanatosideC (8CI); Allocor; Cedilanid; Ceglunat; Ceglunate; Celadigal; Celanid; Celanide;Cetosanol; Digilanide C; Digilanogen C; Isolanid; Isolanide; Lanatigen C;Lanimerck; NSC 119991; NSC 7533 |
| Density: | 1.42g/cm3 |
| Melting Point: | 272-274°C |
| Boiling Point: | °Cat760mmHg |
| Flash Point: | °C |
| Hazard Symbols: |
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| Risk Codes: | 23/24/25 |
| Safety: | Poison by ingestion, intraperitoneal, and intravenous routes. When heated to decomposition it emits acrid smoke and irritating fumes. |
| PSA: | 288.28000 |
| LogP: | 0.61310 |
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Chemistry
Molecular Structure of Lanatoside C (CAS NO. 17575-22-3):
EINECS: 241-546-1
IUPAC Name: [6-[6-[6-[[12,14-Dihydroxy-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]-4-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2-methyloxan-3-yl]oxy-2-methyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl] acetate
Molecular Formula: C49H76O20
Molecular Weight: 985.115740 g/mol
XLogP3: 0.2
H-Bond Donor: 8
H-Bond Acceptor: 20
Canonical SMILES: CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CC(C5(C4(CCC5C6=CC(=O)OC6)O)C)O)C)O)OC7CC(C(C(O7)C)OC8CC(C(C(O8)C)OC9C(C(C(C(O9)CO)O)O)O)OC(=O)C)O
InChI: InChI=1S/C49H76O20/c1-21-43(67-38-17-32(53)44(22(2)62-38)68-39-18-33(64-24(4)51)45(23(3)63-39)69-46-42(58)41(57)40(56)34(19-50)66-46)31(52)16-37(61-21)65-27-9-11-47(5)26(14-27)7-8-29-30(47)15-35(54)48(6)28(10-12-49(29,48)59)25-13-36(55)60-20-25/h13,21-23,26-35,37-46,50,52-54,56-59H,7-12,14-20H2,1-6H3
InChIKey: JAYAGJDXJIDEKI-UHFFFAOYSA-N
Index of Refraction: 1.608
Molar Refractivity: 239.69 cm3
Molar Volume: 692.6 cm3
Surface Tension: 70 dyne/cm
Density: 1.42 g/cm3
Flash Point: °C
Enthalpy of Vaporization: kJ/mol
Boiling Point: °C at 760 mmHg
Vapour Pressure: mmHg at 25 °C
Storage Temp.: -20 °C
Toxicity Data With Reference
| 1. | ipr-rat LDLo:10 mg/kg | TXAPA9 Toxicology and Applied Pharmacology. 1 (1959),156. | ||
| 2. | ivn-rat LD50:30 mg/kg | AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. 155 (1965),165. | ||
| 3. | ipr-mus LD50:7 mg/kg | AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. 155 (1965),165. | ||
| 4. | ivn-mus LD50:8100 µg/kg | NIIRDN “Drugs in Japan. Ethical Drugs, 6th Edition 1982“ Edited by Japan Pharmaceutical Information Center. 6 (1982),877. | ||
| 5. | ivn-dog LD50:340 µg/kg | IVEJAC Indian Veterinary Journal. 57 (1980),31. | ||
| 6. | ivn-cat LDLo:230 µg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 19 (1969),657. | ||
| 7. | orl-gpg LD50:100 mg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 15 (1965),481. | ||
| 8. | ivn-gpg LDLo:502 µg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 17 (1967),1237. |
Safety Profile
Safety Information of Lanatoside C (CAS NO. 17575-22-3):
Hazard Codes: T 
Risk Statements: 23/24/25
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed
Safety Statements: 36/37/39-45
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR: UN 2811 6.1/PG 2
WGK Germany: 3
RTECS: OE2100000
Poison by ingestion, intraperitoneal, and intravenous routes. When heated to decomposition it emits acrid smoke and irritating fumes.
Specification
Lanatoside C with cas registry number of 17575-22-3 is a cardiac glycoside, also known as Isolanid ; Cedilanid ; Ceglunate ; Celadigal ; Cetosanol ; Isolanide ; Lanimerck ; Celanid ; Digilanide C . It can be used by the intravenous route, marked as Cedilanide in Brazil by Novartis.