Common name
selamectin
Formula
C43H63NO11
CAS
165108-07-6
IUPAC name
(5Z,25S)-25-cyclohexyl-4'-O-de(2,6-dideoxy-3-O-methyl-?-L-arabino-hexopyranosyl)-5-demethoxy-25-de(1-methylpropyl)-22,23-dihydro-5-(hydroxyimino)avermectin A1a
SMILES
C[C@H]1/C=C/C=C/2\CO[C@@H]3/C(=N\O)/C(=C[C@@H](C(=O)O[C@H]4C[C@@H](C/C=C(\C)/[C@H]1O[C@H]1C[C@@H]([C@H]([C@H](C)O1)O)OC)O[C@@]1(CC[C@H](C)[C@@H](C5CCCCC5)O1)C4)[C@]23O)C
INCHI
InChI=1S/C43H63NO11/c1-24-11-10-14-30-23-50-40-36(44-48)27(4)19-33(43(30,40)47)41(46)52-32-20-31(16-15-25(2)38(24)53-35-21-34(49-6)37(45)28(5)51-35)54-42(22-32)18-17-26(3)39(55-42)29-12-8-7-9-13-29/h10-11,14-15,19,24,26,28-29,31-35,37-40,45,47-48H,7-9,12-
Physicochemical Properties
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Insecticide-likeness scores
The higher the score, the better the insecticide-likeness
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