去乙酰华蟾毒精

去乙酰华蟾毒精 基本信息
CAS号 4026-95-3 分子式 C24H32O5
分子量 400.50800 精确质量  400.22500
PSA  83.20000 LogP  3.22910

等价的CAS号:

4026-95-3,111863-74-2,117926-09-7

基本信息 展开↓

CAS号:
4026-95-3
3D弹球模型:
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分子式:
C24H32O5
分子量:
400.50800
中文名称:
去乙酰华蟾毒精
英文名称:
Cinobufagin, deacetyl-
中文别名:
去乙酰华蟾毒精;
去乙酰基华蟾毒精;
去乙酰华蟾蜍精
英文别名:
Cinobufagin, deacetyl-;
Deacetylcinobufagine;
16-deacetylcinobufagin;
Deacetylcinobufagin;
Desacetylcinobufagin
精确分子量/精确质量:
400.22500
极性分子表面积/PSA:
83.20000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: IXZHDDUFQVXHIL-UOAIQHMYSA-N

物化性质展开↓

密度:
1.31g/cm3
熔点:
278-280ºC
沸点:
601.9ºC at 760 mmHg
闪点:
208.1ºC
折射率:
1.618
蒸汽压:
5.35E-17mmHg at 25°C

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EI2963500
CHEMICAL NAME :
5-beta-Bufa-20,22-dienolide, 3-beta,16-beta-dihydroxy-14,15-beta-epoxy-
CAS REGISTRY NUMBER :
4026-95-3
LAST UPDATED :
199712
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C24-H32-O5
MOLECULAR WEIGHT :
400.56

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
15 ug/kg
TOXIC EFFECTS :
Behavioral - tremor Behavioral - convulsions or effect on seizure threshold Behavioral - antipsychotic
REFERENCE :
CPBTAL Chemical and Pharmaceutical Bulletin. (Japan Pub. Trading Co., USA, 1255 Howard St., San Francisco, CA 94103) V.6- 1958- Volume(issue)/page/year: 24,1714,1976
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - cat
DOSE/DURATION :
4415 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 3,111,1961
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