13408-56-5

Name PONASTERONE A
CAS 13408-56-5
Molecular Formula C27H44O6
MDL Number MFCD00272144
Molecular Weight 464.63
MOL File 13408-56-5.mol

Chemical Properties

Melting point  259-260° (dec)
alpha  D15 +90° (methanol)
Boiling point  640.5±55.0 °C(Predicted)
density  1.22±0.1 g/cm3(Predicted)
storage temp.  −20°C
solubility  Methanol (Slightly, Sonicated), Pyridine (Slightly)
form  White to off-white powder.
pka 14.13±0.70(Predicted)
color  White to Off-White
biological source synthetic (organic)
InChIKey PJYYBCXMCWDUAZ-JJJZTNILSA-N
SMILES C12=CC([C@]3([H])C[C@@H](O)[C@@H](O)C[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21O)[C@](O)(C)[C@H](O)CCC(C)C)=O |&1:3,6,8,11,13,17,19,22,24,27,r|
CAS DataBase Reference 13408-56-5(CAS DataBase Reference)

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids

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