Common name
milbemectin
Formula
C31H44O7 (milbemycin A3) + C32H46O7 (milbemycin A4)
CAS
51596-10-2 (milbemycin A3+ 51596-11-3 (milbemycin A4)
IUPAC name
(6R,25R)-5-O-demethyl-28-deoxy-6,28-epoxy-25-ethylmilbemycin B mixture with (6R,25R)-5-O-demethyl-28-deoxy-6,28-epoxy-25-methylmilbemycin B
SMILES
CC[C@@H]1[C@@H](C)CC[C@]2(C[C@@H]3C[C@@H](C/C=C(\C)/C[C@@H](C)/C=C/C=C/4\CO[C@@H]5[C@@H](C(=C[C@@H](C(=O)O3)[C@]45O)C)O)O2)O1
INCHI
InChI=1S/C32H46O7/c1-6-27-21(4)12-13-31(39-27)17-25-16-24(38-31)11-10-20(3)14-19(2)8-7-9-23-18-36-29-28(33)22(5)15-26(30(34)37-25)32(23,29)35/h7-10,15,19,21,24-29,33,35H,6,11-14,16-18H2,1-5H3/b8-7+,20-10+,23-9+/t19-,21-,24+,25-,26-,27+,28+,29+,31+,32+/m0/
Physicochemical Properties
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Radar annotation
Insecticide-likeness scores
The higher the score, the better the insecticide-likeness
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