Arenobufagin 阿诺布法金

CAS 464-74-4 MFCD01740820

化学结构图

464-74-4
SMILES: C[C@]12CC[C@H](O)C[C@H]1CC[C@@H]1[C@@H]2[C@H](O)C(=O)[C@]2(C)[C@@H](c3ccc(=O)oc3)CC[C@]12O

化学属性

Mol. FormulaC24H32O6
Mol. Weight417
Melting Point222-228 ºC
Density1.349

别名和识别编码

Chemical NameArenobufagin
Synonym (3beta,5beta,11alpha)-3,11,14-Trihydroxy-12-oxobufa-20,22-dienolide 3,11,14-trihydroxy-12-oxo-bufa-20,22-dienolide Arenobufagin Bufa-20,22-dienolide, 3,11,14-trihydroxy-12-oxo- arenobufagin
CAS Number464-74-4
InChIKeyJGDCRWYOMWSTFC-AZGSIFHYSA-N
Wiswesser Line NotationL E5 B666 DVTJ A1 CQ E1 IQ OQ F- ET6OVJ
LabNetwork Molecule IDLN01341622
PubChem Substance ID12305198
InChIInChI=1S/C24H32O6/c1-22-9-7-15(25)11-14(22)4-5-17-19(22)20(27)21(28)23(2)16(8-10-24(17,23)29)13-3-6-18(26)30-12-13/h3,6,12,14-17,19-20,25,27,29H,4-5,7-11H2,1-2H3/t14-,15+,16-,17-,19-,20+,22+,23+,24+/m1/s1
MDL Number
Chemical Name Translation阿诺布法金
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安全信息

RTECSEI2996000 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Mammal - cat
DOSE/DURATION           : 77 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMPCAS Journal of Medicinal and Pharmaceutical Chemistry.  (Washington, DC)
   V.1-5, 1959-62.  For publisher information, see JMCMAR.
   Volume(issue)/page/year: 3,111,1961

GHS Symbol

系列性分类

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