Gentianine 秦艽甲素

CAS 439-89-4 MFCD00801129

化学结构图

439-89-4
SMILES: C=Cc1cncc2c1CCOC2=O

化学属性

Mol. FormulaC₁₀H₉NO₂
Mol. Weight175.18
Melting Point84-86 ºC
Density1.225
Boiling Point

别名和识别编码

Chemical NameGentianine
Synonym 1H-Pyrano(3,4-c)pyridin-1-one, 5-ethenyl-3,4-dihydro- 5-Ethenyl-3,4-dihydro-1H-pyrano(3,4-c)pyridin-1-one 5-Ethenyl-3,4-dihydro-1H-pyrano[3,4-c]pyridin-1-one; 5-Vinyl-3,4-dihydropyrano[3,4-c]pyridin-1-one 5-ethenyl-3,4-dihydro-1H-pyrano(3,4-c)pyridin-1-one Gentianine gentianine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {PubChem} gentianine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {hazard_com} Nicotinic acid, 4-(2-hydroxyethyl)-5-vinyl-, gamma-lactone
CAS Number439-89-4
Beilstein Registry Number0137011
Chemical Name Translation秦艽甲素
LabNetwork Molecule IDLN01285547
MDL Number
PubChem Substance ID354616
InChIInChI=1S/C10H9NO2/c1-2-7-5-11-6-9-8(7)3-4-13-10(9)12/h2,5-6H,1,3-4H2
EC Number
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安全信息

RTECSUQ1374500 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 276 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPMSAE Journal of Pharmaceutical Sciences.  (American Pharmaceutical Assoc.,
   2215 Constitution Ave., NW, Washington, DC 20037)  V.50-    1961-
   Volume(issue)/page/year: 63,1341,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 500 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
REFERENCE :
   PAHEAA Pharmaceutica Acta Helvetiae.  (Schweizerische Apothekerzeitung,
   Postfach 3006, CH3000 Bern, 7, Switzerland)  V.1-    1926-
   Volume(issue)/page/year: 26,333,1951

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 400 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
REFERENCE :
   PLMEAA Planta Medica.  (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart
   1, Fed. Rep. Ger.) V.1-    1953-  Volume(issue)/page/year: 25,258,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rode

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 250 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
REFERENCE :
   PAHEAA Pharmaceutica Acta Helvetiae.  (Schweizerische Apothekerzeitung,
   Postfach 3006, CH3000 Bern, 7, Switzerland)  V.1-    1926-
   Volume(issue)/page/year: 26,333,1951

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WGK Germany
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系列性分类

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