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4026-95-3

4026-95-3 structure
4026-95-3 structure
  • Name: Deacetylcinobufagin
  • Chemical Name: Cinobufagin, deacetyl
  • CAS Number: 4026-95-3
  • Molecular Formula: C24H32O5
  • Molecular Weight: 400.508
  • Catalog: Research Areas Others
  • Create Date: 2018-05-31 08:00:00
  • Modify Date: 2024-01-16 14:26:53
  • Desacetylcinobufagin is a natural compound used for microbial transformation.

Name Cinobufagin, deacetyl
Synonyms Desacetylcinobufagin
5β-Bufa-20,22-dienolide, 14,15β-epoxy-3β,16β-dihydroxy-
(3β,5β,15β,16β)-3,16-Dihydroxy-14,15-epoxybufa-20,22-dienolide
Bufa-20,22-dienolide, 14,15-epoxy-3,16-dihydroxy-, (3β,5β,15β,16β)-
Deacetylcinobufagin
16-deacetylcinobufagin
Deacetylcinobufagine
Density 1.3±0.1 g/cm3
Boiling Point 601.9±55.0 °C at 760 mmHg
Melting Point 278-280ºC
Molecular Formula C24H32O5
Molecular Weight 400.508
Flash Point 208.1±25.0 °C
Exact Mass 400.224976
PSA 83.20000
LogP 2.00
Vapour Pressure 0.0±3.9 mmHg at 25°C
Index of Refraction 1.619
Storage condition -20°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EI2963500
CHEMICAL NAME :
5-beta-Bufa-20,22-dienolide, 3-beta,16-beta-dihydroxy-14,15-beta-epoxy-
CAS REGISTRY NUMBER :
4026-95-3
LAST UPDATED :
199712
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C24-H32-O5
MOLECULAR WEIGHT :
400.56

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
15 ug/kg
TOXIC EFFECTS :
Behavioral - tremor Behavioral - convulsions or effect on seizure threshold Behavioral - antipsychotic
REFERENCE :
CPBTAL Chemical and Pharmaceutical Bulletin. (Japan Pub. Trading Co., USA, 1255 Howard St., San Francisco, CA 94103) V.6- 1958- Volume(issue)/page/year: 24,1714,1976
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - cat
DOSE/DURATION :
4415 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 3,111,1961