deoxyaconitine
Suppliers
Names
[ CAS No. ]:
3175-95-9
[ Name ]:
deoxyaconitine
[Synonym ]:
Aconitine,deoxy
(1α,6α,14α,15α,16β)-8-Acetoxy-20-ethyl-13,15-dihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl benzoate
deoxyaconitine
Aconitane-8,13,14,15-tetrol, 20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)-, 8-acetate 14-benzoate, (1α,6α,14α,15α,16β)-
Chemical & Physical Properties
[ Density]:
1.3±0.1 g/cm3
[ Boiling Point ]:
680.6±55.0 °C at 760 mmHg
[ Melting Point ]:
177-180℃
[ Molecular Formula ]:
C34H47NO10
[ Molecular Weight ]:
629.738
[ Flash Point ]:
365.4±31.5 °C
[ Exact Mass ]:
629.320007
[ PSA ]:
133.22000
[ LogP ]:
1.45
[ Vapour Pressure ]:
0.0±2.2 mmHg at 25°C
[ Index of Refraction ]:
1.603
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- AR5569100
- CHEMICAL NAME :
- Aconitane-8,13,14,15-tetrol, 20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)-, 8- acetate 14-benzoate, (1-alpha,3-alpha,6-alpha,14-alpha,15-alpha,16-beta)-
- CAS REGISTRY NUMBER :
- 3175-95-9
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C34-H47-N-O10
- MOLECULAR WEIGHT :
- 629.82
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1900 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CYLPDN Zhongguo Yaoli Xuebao. Acta Pharmacologica Sinica. Chinese Journal of Pharmacology. (China International Book Trading Corp., POB 2820, Beijing, Peop. Rep. China) V.1- 1980- Volume(issue)/page/year: 2,170,1981