Androst-2-ene-2-carbonitrile,3,17-dihydroxy-4,17-dimethyl-4,5-epoxy-,(4-alpha,5-alpha, 17-beta)-

CAS 80471-63-2 MFCD00199296

化学结构图

80471-63-2
SMILES: C[C@]1(O)CC[C@H]2[C@@H]3CC[C@@]45O[C@]4(C)C(O)=C(C[C@]5(C)[C@H]3CC[C@]12C)C#N

化学属性

Mol. FormulaC22H31NO3
Mol. Weight357

别名和识别编码

Chemical NameAndrost-2-ene-2-carbonitrile,3,17-dihydroxy-4,17-dimethyl-4,5-epoxy-,(4-alpha,5-alpha, 17-beta)-
CAS Number80471-63-2
Synonym (4-alpha,5-alpha,17-beta)-4,5-Epoxy-3,17-dihydroxy-4,17-dimethylandrost-2-ene-2-carbonitrile Win 32729 (4?,5?,17?)-4,5-Epoxy-3,17-dihydroxy-4,17-dimethylandrost-2-ene-2-carbonitrile WIN 32729 Epostane
Chemical Name Translation
MDL NumberMFCD00199296
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分类

  • Pharmaceuticals
  • Intermediates & Fine Chemicals
  • Steroids

产品应用

  • 3?-Hydroxysteroid dehydrogenase inhibitor; a derivative of trilostane. Interceptive.

相关文献及参考

  • Creange, J.E., et al.: Contraception, 24, 289 (1981),
  • Christiansen, R.G., et al.: J. Med. Chem., 27, 928 (1984),
  • Han, Z., et al.: J. Biol. Chem., 272, 13432 (1997),

安全信息

RTECSBV8087520 
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - woman
DOSE/DURATION           : 96 mg/kg
TOXIC EFFECTS :
   Gastrointestinal - nausea or vomiting
   Reproductive - Effects on Embryo or Fetus - fetal death
REFERENCE :
   CCPTAY Contraception.  (Geron-X, Inc., POB 1108, Los Altos, CA 94022)  V.1-
   1970-  Volume(issue)/page/year: 35,111,1987

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Primate - monkey
DOSE                    : 100 mg/kg
SEX/DURATION            : female 5 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Maternal Effects - menstrual cycle changes or disorders
REFERENCE :
   CCPTAY Contraception.  (Geron-X, Inc., POB 1108, Los Altos, CA 94022)  V.1-
   1970-  Volume(issue

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 48 mg/kg
SEX/DURATION            : female 10 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - female fertility index (e.g. # females pregnant
   per # sperm positive females; # females pregnant per # females mated)
REFERENCE :
   CYLPDN Zhongguo Yaoli Xuebao.  Acta Pharmacologica Sinica.  Chinese Journal
   of Pharmacology.  (China International Book Trading Corp., POB 2820,
   Beijing, Peop. Rep. China)  V.1-    1980-  Volume(issue)/page/year:
   14,437,1993

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 50 mg/kg
SEX/DURATION            : female 10 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - abortion
REFERENCE :
   BIREBV Biology of Reproduction.  (Soc. for the Study of Reproduc

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Mammal - dog
DOSE                    : 2500 ug/kg
SEX/DURATION            : female 1 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Maternal Effects - other effects
   Endocrine - estrogenic
REFERENCE :
   THGNBO Theriogenology.  (Geron-X, Inc., P.O. Box 1108, Los Altos, CA 94022)
   V.1-    1974-  Volume(issue)/page/year: 30,497,1988

系列性分类

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