吐根酚碱氯化氢

吐根酚碱氯化氢 基本信息
CAS号 5853-29-2 分子式 C28H39ClN2O4
分子量 503.07300 精确质量  502.26000
PSA  63.19000 LogP  5.70910

等价的CAS号:

3738-70-3,5853-29-2,5884-43-5,5884-44-6,17132-42-2

基本信息 展开↓

CAS号:
5853-29-2
3D弹球模型:
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分子式:
C28H39ClN2O4
分子量:
503.07300
中文名称:
吐根酚碱氯化氢
英文名称:
(-)-CEPHAELINE, DIHYDROCHLORIDE
中文别名:
吐根酚碱氯化氢;
(-)-CEPHAELINE, DIHYDROCHLORIDE
英文别名:
(-)-CEPHAELINE, DIHYDROCHLORIDE;
10,11,7'-Trimethoxy-emetan-6'-ol,Hydrochlorid;
cephaeline dihydrochloride;
10,11,7'-trimethoxy-emet-1'-ene-9,6'-diol;
Alangicine;
10,11,7'-trimethoxy-emetan-6'-ol,dihydrochloride;
10,11,7'-Trimethoxy-emetan-6'-ol,Dihydrochlorid
精确分子量/精确质量:
502.26000
极性分子表面积/PSA:
63.19000
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: NWYUGUJIBCMDEB-QJAXAJGISA-N

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
FJ9450000
CHEMICAL NAME :
Cephaeline hydrochloride
CAS REGISTRY NUMBER :
5853-29-2
LAST UPDATED :
199206
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C28-H38-N2-O4.2Cl-H
MOLECULAR WEIGHT :
539.60
WISWESSER LINE NOTATION :
T B666 GNTT&J E2 LO1 MO1 D1- BT66 CMT&J HQ IO1 &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
10 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 104,421,1952
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
6500 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 10,73,1917/1918
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
74970 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. (Bethesda, MD 20205) Volume(issue)/page/year: JAN1986
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
20530 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. (Bethesda, MD 20205) Volume(issue)/page/year: JAN1986
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
8 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 10,73,1917/1918
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