去乙酰毛花苷

去乙酰毛花苷 基本信息
CAS号 17598-65-1 分子式 C47H74O19
分子量 943.07900 精确质量  942.48200
PSA  282.21000 LogP  0.04230

基本信息 展开↓

CAS号:
17598-65-1
3D弹球模型:
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分子式:
C47H74O19
分子量:
943.07900
中文名称:
去乙酰毛花苷
英文名称:
deslanoside
中文别名:
去乙酰毛花苷;
毛地黄苷C
英文别名:
deslanoside;
deslanatoside;
Desacetyllanatosid C;
glucodigoxin;
Desace;
de-O-acetyl-lanatoside C;
Desaci;
DESLANOSIDUM;
cedilanidd;
Deslanatoside C;
deacetyl-lanatoside;
Deacetyllanatoside C,Desacetyllanatoside C;
deacetyl-lanatoside C;
sediranido;
Deslanoside
精确分子量/精确质量:
942.48200
极性分子表面积/PSA:
282.21000
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。
EINECS:
241-568-1
InChI:
InChI=1/C47H74O19/c1-20-41(64-36-16-30(50)42(21(2)60-36)65-37-17-31(51)43(22(3)61-37)66-44-40(56)39(55)38(54)32(18-48)63-44)29(49)15-35(59-20)62-25-8-10-45(4)24(13-25)6-7-27-28(45)14-33(52)46(5)26(9-11-47(27,46)57)23-12-34(53)58-19-23/h12,20-22,24-33,35-4

物化性质展开↓

密度:
1.43g/cm3
熔点:
220-235ºC
折射率:
1.619

安全信息展开↓

危险类别码:
R23/25
安全说明:
1-22-45

合成路线查看所有的合成路线

  • 1469804-92-9

    1469804-92-9

  • ~91%

  • 17598-65-1

    去乙酰毛花苷

  • 20830-75-5

    地高辛

  • +

  • 572-09-8

    乙酰溴-α-D-葡萄糖

  • 17598-65-1

    去乙酰毛花苷

  • 17575-22-3

    毛花苷C

  • 17598-65-1

    去乙酰毛花苷

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
OE2100500
CHEMICAL NAME :
Lanatoside C, deacetyl-
CAS REGISTRY NUMBER :
17598-65-1
BEILSTEIN REFERENCE NO. :
0078187
LAST UPDATED :
199612
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C47-H74-O19
MOLECULAR WEIGHT :
943.21

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 :
10360 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,489,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
8100 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,489,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - cat
DOSE/DURATION :
230 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85ELDJ "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963 Volume(issue)/page/year: -,190,1963 *** REVIEWS *** TOXICOLOGY REVIEW 85ELDJ "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963 Volume(issue)/page/year: -,190,1963 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X7349 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 103 (estimated) No. of Female Employees: 52 (estimated)

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