17-alpha-Butadiynyl-17-beta-hydroxyestr-5(10)-en-3-one

CAS 2010-50-6 MFCD02010506

化学结构图

2010-50-6
SMILES: C#CC#CC1(O)CCC2C3CCC4=C(CCC(=O)C4)C3CCC21C

化学属性

Mol. Weight322.48
Mol. FormulaC22H26O2

别名和识别编码

Wiswesser Line NotationL E5 B666 OV AU- MTJ E1 FQ F1UU2UU1
Chemical NameEstr-5(10)-en-3-one, 17-alpha-butadiynyl-17-beta-hydroxy-
Synonym 17-alpha-Butadiynyl-17-beta-hydroxy-5(10)-estren-3-one 17-alpha-Butadiynyl-17-beta-hydroxyestr-5(10)-en-3-one
CAS Number2010-50-6
InChIKeyCRWMSOOXZANYFV-AANPDWTMSA-N
PubChem Substance ID23617636
InChIInChI=1S/C22H26O2/c1-3-4-11-22(24)13-10-20-19-7-5-15-14-16(23)6-8-17(15)18(19)9-12-21(20,22)2/h1,18-20,24H,5-10,12-14H2,2H3/t18-,19-,20+,21+,22+/m1/s1
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安全信息

RTECSKG7962000 
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 10 mg/kg
SEX/DURATION            : female 2-3 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - pre-implantation mortality (e.g. reduction in
   number of implants per female; total number of implants per corpora lutea)
REFERENCE :
   STEDAM Steroids.  (Holden-Day Inc., 4432 Telegraph Ave., Oakland, CA 94609)
   V.1-    1963-  Volume(issue)/page/year: 4,801,1964

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 27500 ug/kg
SEX/DURATION            : female 11 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Fertility - female fertility index (e.g. # females pregnant
   per # sperm positive females; # females pregnant per # females mated)
REFERENCE :
   STEDAM Steroids.  (Holden-Day Inc., 4432 Telegraph Ave., Oakland, CA 94609)
   V.1-    1963-  Volume(issue)/page/year: 4,801,1964

系列性分类

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