Common name
spinosad
Formula
C41H65NO10 (spinosyn A) + C42H67NO10 (spinosyn D)
CAS
168316-95-8 (131929-60-7 + 131929-63-0)
IUPAC name
(2R,3aS,5aR,5bS,9S,13S,14R,16aS,16bR)-2-[(6-deoxy-2,3,4-tri-O-methyl-?-L-mannopyranosyl)oxy]-13-[[(2R,5S,6R)-5-(dimethylamino)tetrahydro-6-methyl-2H-pyran-2-yl]oxy]-9-ethyl-2,3,3a,5a,5b,6,9,10,11,12,13,14,16a,16b-tetradecahydro-14-methyl-1H-as-indaceno[3,
SMILES
CC[C@H]1CCC[C@@H]([C@@H](C)C(=O)C2=C[C@@H]3[C@@H](C=C[C@@H]4C[C@H](C[C@@H]34)O[C@H]3[C@@H]([C@@H]([C@H]([C@H](C)O3)OC)OC)OC)[C@@H]2CC(=O)O1)O[C@H]1CC[C@@H]([C@@H](C)O1)N(C)C
INCHI
InChI=1S/C41H65NO10/c1-10-26-12-11-13-34(52-36-17-16-33(42(5)6)23(3)48-36)22(2)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(47-9)39(46-8)38(45-7)24(4)49-41/h14-15,20,22-31,33-34,36,38-41H,10-13,16-19,21H2,1-9H3/t22-,23-,24+,2
Physicochemical Properties
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Lipophilicity
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Radar annotation
Insecticide-likeness scores
The higher the score, the better the insecticide-likeness
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