Home Aminos Avermectin B1, 4''-deoxy-4''-(methylamino)-, (4''R)-

Avermectin B1, 4''-deoxy-4''-(methylamino)-, (4''R)-

CAS No.:
119791-41-2
Catalog Number:
AG01DQ32
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01DQ32
Chemical Name:
Avermectin B1, 4''-deoxy-4''-(methylamino)-, (4''R)-
CAS Number:
119791-41-2
MDL Number:
MFCD09027778
IUPAC Name:
(1'R,2R,3S,4'S,6S,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'R,24'S)-2-[(2S)-butan-2-yl]-21',24'-dihydroxy-12'-[(2R,4S,5S,6S)-4-methoxy-5-[(2S,4S,5S,6S)-4-methoxy-6-methyl-5-(methylamino)oxan-2-yl]oxy-6-methyloxan-2-yl]oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one
InChI:
InChI=1S/C49H75NO13/c1-12-26(2)44-29(5)18-19-48(63-44)24-35-21-34(62-48)17-16-28(4)43(27(3)14-13-15-33-25-56-46-42(51)30(6)20-36(47(52)59-35)49(33,46)53)60-40-23-38(55-11)45(32(8)58-40)61-39-22-37(54-10)41(50-9)31(7)57-39/h13-16,18-20,26-27,29,31-32,34-46,50-51,53H,12,17,21-25H2,1-11H3/b14-13+,28-16+,33-15+/t26-,27-,29-,31-,32-,34+,35-,36-,37-,38-,39-,40-,41-,42+,43-,44+,45-,46+,48+,49+/m0/s1
InChI Key:
CXEGAUYXQAKHKJ-NSBHKLITSA-N
Properties
Complexity:
1750  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
20  
Defined Bond Stereocenter Count:
3  
Exact Mass:
885.524g/mol
Formal Charge:
0
Heavy Atom Count:
63  
Hydrogen Bond Acceptor Count:
14  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
886.133g/mol
Monoisotopic Mass:
885.524g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
162A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Literature
Title Journal
Using organic-certified rather than synthetic pesticides may not be safer for biological control agents: selectivity and side effects of 14 pesticides on the predator Orius laevigatus. Chemosphere 20120501
Cross-resistance, mode of inheritance and stability of resistance to emamectin in Spodoptera litura (Lepidoptera: Noctuidae). Pest management science 20100801
Toxicity and residual efficacy of chlorantraniliprole, spinetoram, and emamectin benzoate to obliquebanded leafroller (Lepidoptera: Tortricidae). Journal of economic entomology 20100801
Induction and transmission of tolerance to the synthetic pesticide emamectin benzoate in field and laboratory populations of diamondback moth. Journal of economic entomology 20100801
New ventures in the chemistry of avermectins. Bioorganic & medicinal chemistry 20090615
[Determination of avermectin residues in tea by ultra-performance liquid chromatography-electrospray tandem mass spectrometry]. Se pu = Chinese journal of chromatography 20090301
[Effects of applying Sophora alopecuroids extracts and emamectin on the growth, development, and fecundity of diamondback moth plutella xylostella]. Ying yong sheng tai xue bao = The journal of applied ecology 20071201
Determination of abamectin, doramectin, emamectin, eprinomectin, ivermectin, and moxidectin in milk by liquid chromatography electrospray tandem mass specrometry. Journal of AOAC International 20060101
Emamectin, a novel insecticide for controlling field crop pests. Pest management science 20021101
Determination of emamectin residues in the tissues of Atlantic salmon (Salmo salar L.) using HPLC with fluorescence detection. Journal of agricultural and food chemistry 20011101
Simultaneous determination of emamectin and ivermectin residues in Atlantic salmon muscle by liquid chromatography with fluorescence detection. Journal of AOAC International 20010101
Biorational agents--mechanism and importance in IPM and IRM programs for controlling agricultural pests. Mededelingen (Rijksuniversiteit te Gent. Fakulteit van de Landbouwkundige en Toegepaste Biologische Wetenschappen) 20010101
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