3-Deoxyestrone

CAS 53-45-2 MFCD00869287

化学结构图

53-45-2
SMILES: C[C@]12CC[C@@H]3c4ccccc4CC[C@H]3[C@@H]1CCC2=O

化学属性

Mol. FormulaC18H22O
Mol. Weight254.40

别名和识别编码

Chemical NameEstra-1,3,5(10)-trien-17-one
Wiswesser Line NotationL E5 B666 FVTTT&J E1
Synonym 3-Deoxyestrone 3-Deoxyoestrone 3-deoxyestrone Adopron Agrestin Deoxyestrone Desoxyestrone Estratrien-17-one Oestra-1,3,5(10)-trien-17-one
Beilstein Registry Number4689308
CAS Number53-45-2
LabNetwork Molecule IDLN04540050
PubChem Substance ID5882
InChIInChI=1S/C18H22O/c1-18-11-10-14-13-5-3-2-4-12(13)6-7-15(14)16(18)8-9-17(18)19/h2-5,14-16H,6-11H2,1H3/t14-,15-,16+,18+/m1/s1
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安全信息

RTECSKG7744000 
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 4 mg/kg
SEX/DURATION            : male 1 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Paternal Effects - testes, epididymis, sperm duct
   Reproductive - Paternal Effects - prostate, seminal vesicle, Cowper's gland,
   accessory glands
REFERENCE :
   ACENA7 Acta Endocrinologica (Copenhagen).  (Periodica, Skolegade 12 E,
   DK-2500 Valby, Denmark) V.1-    1948-  Volume(issue)/page/year: 49,193,1965

系列性分类

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