Vallaroside

CAS 4477-75-2 MFCD04477752

化学结构图

4477-75-2
SMILES: COC1C(O)C(C)OC(OC2CCC3(C)C(CCC4C3CCC3(C)C(C5=CC(=O)OC5)CCC43O)C2)C1O

化学属性

Mol. Weight534.76
Mol. FormulaC30H46O8

别名和识别编码

Chemical NameVallaroside
Chemicalbook IDCB82146852
Synonym Card-20(22)-enolide,
CAS Number4477-75-2
InChIKeyVPUNMTHWNSJUOG-LMYROWQCSA-N
PubChem Substance ID199590
InChIInChI=1S/C30H46O8/c1-16-24(32)26(35-4)25(33)27(37-16)38-19-7-10-28(2)18(14-19)5-6-22-21(28)8-11-29(3)20(9-12-30(22,29)34)17-13-23(31)36-15-17/h13,16,18-22,24-27,32-34H,5-12,14-15H2,1-4H3/t16-,18+,19-,20+,21-,22+,24-,25+,26-,27-,28-,29+,30-/m0/s1
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安全信息

RTECSYV9550000 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Mammal - cat
DOSE/DURATION           : 171 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 13,1029,1970

系列性分类

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