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8056-92-6

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Basic Information
CAS No.: 8056-92-6
Name: Bisecurin I
Molecular Structure:
Molecular Structure of 8056-92-6 (Bisecurin I)
Formula: C24H32O4•C21H26O2
Molecular Weight: 695.03
Synonyms: Bisecurin I
Safety: Human systemic effects by ingestion: skin dermatitis, weight loss or decreased weight gain. Questionable carcinogen producing liver tumors. A steroid. When heated to decomposition it emits acrid smoke and fumes.
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Chemistry

Product Name: Bisecurin I (CAS NO.8056-92-6)


Molecular Formula: C24H32O4•C21H26O2
Molecular Weight: 695.03g/mol
Mol File: 8056-92-6.mol
H-Bond Donor: 1
H-Bond Acceptor: 4
Structure Descriptors of Bisecurin I (CAS NO.8056-92-6):
  IUPAC Name: 1-[(3S,8R,9S,10R,13S,14S,17R)-17-acetyl-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,
16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]ethanone;(8R,9S,13S,14S,17R)-17-ethynyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol

Toxicity Data With Reference

1.    

orl-wmn TDLo:63,504 µg/kg/12Y-I:CAR,LIV,MET

     LANCAO    Lancet. 1 (1980),273.
2.    

orl-wmn TDLo:220 µg/kg/2W:SKN

     ARDEAC    Archives of Dermatology. 113 (1976),333.
3.    

orl-mus TDLo:186 mg/kg/93W-C:NEO

     GMCRDC    Gann Monograph on Cancer Research. 17 (1975),205.

Safety Profile

Human systemic effects by ingestion: skin dermatitis, weight loss or decreased weight gain. Questionable carcinogen producing liver tumors. A steroid. When heated to decomposition it emits acrid smoke and fumes.

Specification

 Bisecurin I , its CAS NO. is 8056-92-6, the synonyms are Ethynodiol diacetate - mestranol mixture ; Ethynodiol diacetate-mestranol ; Ethynodiol mixed with mestranol ; Mestranol mixed with ethynodiol ; Metrulen ; Ovulen ; 19-Nor-17-alpha-pregn-4-en-20-yne-3-beta,17-diol mixed with 3-methoxy-17-alpha-19-norpregna-1,3,5(10)-trien-20-yn-17-ol ; 19-Norpregn-4-en-20-yne-3,17-diol, diacetate, (3beta,17alpha)-, mixt. with (17alpha)-3-methoxy-19-norpregna-1,3,5(10)-trien-20-yn-17-ol ; 19-Norpregn-4-en-20-yne-3beta,17alpha-diol diacetate mixt. with 3-methoxy-19-norpregna-1,3,5(10) trien-20-yn-17alpha-ol .