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5544-25-2

5544-25-2结构式
5544-25-2结构式

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英文名 (E)-3-[(6R,6aS)-4-hydroxy-6-methoxy-3-methyl-11-oxo-5,6,6a,7-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]prop-2-enamide
英文别名 Roche 5-9000
Anthramycin-methylether
Antibiotic A
Anthramycin 11-methyl ether
11-O-Methyl-anthramycin
密度 1.4g/cm3
沸点 631.8ºC at 760 mmHg
分子式 C17H19N3O4
分子量 329.35000
闪点 335.9ºC
精确质量 329.13800
PSA 104.89000
LogP 2.01470
折射率 1.672

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UY8429500
CHEMICAL NAME :
1H-Pyrrolo(2,1-c)(1,4)benzodiazepine-2-acrylamide, 5,10,11,11a-tetrahydro-9-hydroxy- 11-methoxy-8-methyl-5-oxo-, (E)-, monohydrate
CAS REGISTRY NUMBER :
5544-25-2
LAST UPDATED :
199306
DATA ITEMS CITED :
7
MOLECULAR FORMULA :
C17-H19-N3-O4.H2-O
MOLECULAR WEIGHT :
347.41

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3400 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
730 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2900 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
Mutation test systems - not otherwise specified
TYPE OF TEST :
DNA inhibition

MUTATION DATA

TYPE OF TEST :
DNA inhibition
TEST SYSTEM :
Rodent - mouse Ascites tumor
DOSE/DURATION :
5 umol/L
REFERENCE :
CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 29,2195,1969

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