130217-18-4

Name Adenostemmoic acid C
CAS 130217-18-4
Molecular Formula C20H32O6
Molecular Weight 368.47
MOL File 130217-18-4.mol
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Chemical Properties

Boiling point  568.3±50.0 °C(Predicted)
density  1.36±0.1 g/cm3(Predicted)
pka 4.55±0.70(Predicted)
InChIKey RHWBQGFFSHIXKI-VBMXMUPNNA-N
SMILES O[C@@H]1[C@@]([C@]2([H])C[C@H](O)[C@@]3([H])[C@@]4(CCC[C@@](C)(C(=O)O)[C@@]4([H])CC[C@]13C2)C)(O)CO |&1:1,2,3,6,8,10,14,19,23,r|

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