Hellebrigenin 3-acetate

CAS 4064-09-9 MFCD04064099

化学结构图

4064-09-9
SMILES: CC(=O)OC1CCC2(C=O)C3CCC4(C)C(c5ccc(=O)oc5)CCC4(O)C3CCC2(O)C1

化学属性

Mol. FormulaC26H34O7
Mol. Weight458.60

别名和识别编码

Chemical NameHellebrigenin 3-acetate
Chemicalbook IDCB22352383
Wiswesser Line NotationL E5 B666TJ AVH E1 IQ MQ OOV1 F- ET6OVJ
Synonym Bufa-20,22-dienolide, 3-(acetyloxy)-5,14-dihydroxy-19-oxo-,
CAS Number4064-09-9
Beilstein Registry Number0065090
InChIKeyVIOBLZMEZRNYRR-PTGWYJJLSA-N
PubChem Substance ID267436
InChIInChI=1S/C26H34O7/c1-16(28)33-18-5-10-24(15-27)20-6-9-23(2)19(17-3-4-22(29)32-14-17)8-12-26(23,31)21(20)7-11-25(24,30)13-18/h3-4,14-15,18-21,30-31H,5-13H2,1-2H3/t18-,19+,20-,21+,23+,24-,25-,26-/m0/s1
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安全信息

RTECSEI3175900 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Mammal - cat
DOSE/DURATION           : 64 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 99,395,1950

系列性分类

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