78478-28-1

Name PRAERUPTORIN E
CAS 78478-28-1
Molecular Formula C24H28O7
Molecular Weight 428.47
MOL File 78478-28-1.mol
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Chemical Properties

Boiling point  516.5±50.0 °C(Predicted)
density  1.22±0.1 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
form  Powder
color  White to off-white
InChI InChI=1S/C24H28O7/c1-7-14(4)23(27)30-22-21(29-18(26)12-13(2)3)19-16(31-24(22,5)6)10-8-15-9-11-17(25)28-20(15)19/h7-11,13,21-22H,12H2,1-6H3/b14-7-/t21-,22-/m0/s1
InChIKey UFUVJROSOIXJGR-WLISBCLRSA-N
SMILES C(O[C@@H]1C(C)(C)OC2=CC=C3C=CC(=O)OC3=C2[C@@H]1OC(=O)CC(C)C)(=O)/C(/C)=C\C

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