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Alrestatin

Names

[ CAS No. ]:
51411-04-2

[ Name ]:
Alrestatin

[Synonym ]:
Alrestatine
2,3-Dioxopropyl dihydrogen phosphate
Propanal, 2-oxo-3-(phosphonooxy)-
alrestatin

Biological Activity

[Description]:

Alrestatin is an inhibitor of aldose reductase, an enzyme involved in the pathogenesis of complications of diabetes mellitus, including diabetic neuropathy.

[Related Catalog]:

Signaling Pathways >> Metabolic Enzyme/Protease >> Aldose Reductase
Research Areas >> Endocrinology

[Related Small Molecules]

Isoliquiritigenin | Epalrestat | Ranirestat | Tolrestat | Aldose reductase-IN-1 | IMIRESTAT | Alrestatin (sodium) | RISARESTAT | Fidarestat

Chemical & Physical Properties

[ Density]:
1.7±0.1 g/cm3

[ Boiling Point ]:
359.1±44.0 °C at 760 mmHg

[ Molecular Formula ]:
C14H9NO4

[ Molecular Weight ]:
168.042

[ Flash Point ]:
171.0±28.4 °C

[ Exact Mass ]:
167.982376

[ PSA ]:
76.37000

[ LogP ]:
-2.47

[ Vapour Pressure ]:
0.0±1.7 mmHg at 25°C

[ Index of Refraction ]:
1.480

[ Storage condition ]:
-20℃

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DE4080500
CHEMICAL NAME :
1H-Benz(de)isoquinoline-2(3H)-acetic acid, 1,3-dioxo-
CAS REGISTRY NUMBER :
51411-04-2
BEILSTEIN REFERENCE NO. :
0244370
LAST UPDATED :
199703
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C14-H9-N-O4
MOLECULAR WEIGHT :
255.24

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>2500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4405625
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1380 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4118495
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1220 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4118495

Safety Information

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds