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Spinosyn A

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Spinosyn A / CAS : 131929-60-7

Appearance Light gray solid crystal UN 3077
HS 29322090 DG Class 9
Synonyms Ramoplanin; Spinosad; Spinosyn D; (2R-(2R*,3As*,5Ar*,5Bs*,9S*,13S*(2R*,5S*,6R*),14R*,16As*,16Br*))-Ethyl; )Oxy)-13-((5-Dimethylamino)Tetrahydro-6-Methyl-2H-Pyran-2-Yl)Oxy)-9-Ethyl-14-M; Spinosad A; 1H-As-Indaceno(3,2-D)Oxacyclododecin-7,15-Dione, 2-((6-Deoxy-2,3,4-Tri-O-Methyl-Alpha-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-, (2R,3As,5Ar,5Bs,9S,13S,14R,16As,16Br)-; 1H-As-Indaceno(3,2-D)Oxacyclododecin-7,15-Dione, 2,3,3A,5A,5B,6,9,10,11,12,13,14,16A,16B-Tetradecahydro-2-((6-Deoxy-2,3,4-Tri-O-Methyl-Alpha-L-Mannopyranosyl)Oxy)- 13-((5-Dimethylamino)Tetrahydro-6-Methyl-2H-Pyran-2-Yl)Oxy)-9-Ethyl-14-Methyl-, (2R-(2R*,3As*,5Ar*,5Bs*,9S*,13S*(2R*,5S*,6R*),14R*,16As*,16Br*))-; Ccris 8937
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Properties

Summary

Formula
C41H65NO10
Molecular Mass
731.95500
Exact Mass
731.46100
PSA
111.22000
Logp
5.48740
IUPAC
(1S,2R,5S,7R,9R,10S,14R,15S,19S)-15-[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-19-ethyl-14-methyl-7-[(2R,3R,4R,5S,6S)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxy-20-oxatetracyclo[10.10.0.02,10.05,9]docosa-3,11-diene-13,21-dione
SMILES
CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@H]3[C@@H]4C[C@@H](C[C@H]4C=C[C@H]3[C@@H]2CC(=O)O1)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C

Attribute classification

Matter Classification
organic
Category
Agrochemicals > Pesticides

Chemical and Physical Properties

Melting Point
84ºC-99.5 ºC
Density
1.167 g/cm3
Boiling Point
801.515 ºC
Flash Point
438.541 ºC
Appearance
Light gray solid crystal
Acidity and Basicity
neutral

Export information

HS Code
29322090
Export Rebate
13%
UN No.
3077
DG-Class
9

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