Hydrastine

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Names

[ CAS No. ]:
118-08-1

[ Name ]:
Hydrastine

[Synonym ]:
Hydrastine (10 mg)
quinolin-5-yl)
HYDRASTINE
Hydrastinebase
(-)-Beta-Hydrastine
EINECS 204-233-0
MFCD00152561
(-)-B-HYDIASTINE
l-hydrastine
HYDRASTINE,(-)-B

Chemical & Physical Properties

[ Density]:
1.339g/cm3

[ Boiling Point ]:
548.8ºC at 760mmHg

[ Melting Point ]:
132ºC

[ Molecular Formula ]:
C21H21NO6

[ Molecular Weight ]:
383.39500

[ Flash Point ]:
285.7ºC

[ Exact Mass ]:
383.13700

[ PSA ]:
66.46000

[ LogP ]:
2.81110

[ Vapour Pressure ]:
4.28E-12mmHg at 25°C

[ Index of Refraction ]:
1.614

[ Storage condition ]:
−20°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MU6030000
CHEMICAL NAME :
Hydrastine
CAS REGISTRY NUMBER :
118-08-1
BEILSTEIN REFERENCE NO. :
0098575
LAST UPDATED :
199709
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C21-H21-N-O6
MOLECULAR WEIGHT :
383.43
WISWESSER LINE NOTATION :
T C566 DO FO LN EH&&TJ L M- DT56 BVO DHJ HO1 IO1

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 :
104 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CLDND* Compilation of LD50 Values of New Drugs. (J.R. MacDougal, Dept. of National Health and Welfare, Food and Drug Divisions, 35 John St., Ottawa, Ont., Canada)

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302 + H312 + H332

[ Precautionary Statements ]:
P261-P280-P301 + P312 + P330

[ Hazard Codes ]:
Xn: Harmful;

[ Risk Phrases ]:
20/21/22

[ Safety Phrases ]:
S36

[ RIDADR ]:
1544

[ WGK Germany ]:
3

[ RTECS ]:
MU6030000

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1(b)

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • narcotoline-8-(1-phenyl-1H-5-tetrazolyl) ether
  • (S)-3-((R)-6,7-dihydroxy-2-methyl-1,2,3,4-tetrahydro-isoquinolin-1-yl)-6,7-dimethoxy-3H-isobenzofuran-1-one
  • Bromochloromethane
  • [S-(R*,R*)]-6,7-dimethoxy-3-(5,6,7,8-tetrahydro-4-hydroxy-6-methyl-1,3-dioxolo[4,5-g]isoquinolin-5-yl)phthalide
  • diazomethane
  • (S)-6,7-dihydroxy-3-((R)-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3H-isobenzofuran-1-one
  • (+/-)-β-hydrastine

DownStream

  • Nicotinic acid
  • 1,2-Benzenedicarboxylicacid, 3,4-dimethoxy-
  • Formic Acid
  • protocatechuic acid
  • Meconine
  • Hydrastinine
  • 5,6-Dimethoxyphthalaldehydic acid

Related Compounds

  • HYDRASTINE
  • β-hydrastine
  • HydrastineHCl
  • beta-hydrastine
  • (+)-β-Hydrastine
  • dehydrohydrastine
  • 9-(Oxolan-3-ylmethyl)-2,5-dioxa-8-azaspiro[3.5]nonane
  • [3-(Difluoromethoxy)-4-methylphenyl]methanesulfonamide
  • (2-Bromo-1,3-thiazol-5-yl)methanesulfonyl chloride
  • Tert-butyl 2-(2-sulfanylcyclopentyl)piperidine-1-carboxylate
  • N-[4-(aminomethyl)-2-fluorophenyl]-N-methylethane-1-sulfonamide
  • (2-Chloro-3,6-difluorophenyl)methanesulfonyl fluoride
  • 1-(Dimethylamino)propane-2-sulfonyl chloride
  • 4-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)hexanamido]-3-methoxybutanoic acid
  • 1-Chloro-4-methylcycloheptane-1-carbonyl chloride
  • 8-Fluoro-5-nitro-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
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