Common name
rhodojaponin-III
Formula
C20H32O6
CAS
26342-66-5
IUPAC name
(2?,3?,6?,14R)-2,3-epoxygrayanotoxane-5,6,10,14,16-pentol
SMILES
CC1(C)[C@@H]2[C@H]([C@H]3[C@@](C)([C@@H]4CC[C@@H]5[C@H]([C@@]4(C[C@H]([C@]13O)O)C[C@@]5(C)O)O)O)O2
INCHI
InChI=1S/C20H32O6/c1-16(2)15-12(26-15)13-18(4,24)10-6-5-9-14(22)19(10,8-17(9,3)23)7-11(21)20(13,16)25/h9-15,21-25H,5-8H2,1-4H3/t9-,10+,11-,12+,13+,14-,15+,17-,18-,19+,20-/m1/s1
Physicochemical Properties
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Lipophilicity
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Geometric
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Radar annotation
Insecticide-likeness scores
The higher the score, the better the insecticide-likeness
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