Abamectin

Analyte Name

Abamectin

CAS Number

71751-41-2

Molecular Formula

C48H72O14

Molecular Weight

873.08

Accurate Mass

872.49

Flash Point

-20

SMILES

C/C([C@@H](O[C@]1(C[C@@H]([C@H]([C@@H](O1)C)O[C@]2(C[C@@H]([C@H]([C@@H](O2)C)O)OC)[H])OC)[H])[C@H](/C=C/C=C3CO[C@]4([C@@]\3([C@@]([H])(C=C([C@H]4O)C)C(O[C@H](C[C@]5(O6)O[C@]([C@@]([H])(C)CC)([C@H](C=C5)C)[H])C7)=O)O)[H])C)=C\C[C@]76[H]

InChI

InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12+,27-15+,32-14+/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1

IUPAC

(2S,2a'E,2a1'S,4'E,5S,6R,6'S,7'S,8'E,11'R,15'S,17a'R,20'R,20a'R)-6-((S)-sec-butyl)-2a1',20'-dihydroxy-7'-(((2R,4S,5S,6S)-5-(((2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-5,6',8',19'-tetramethyl-2a1',5,6,6',7',10',11',14',15',17a',20',20a'-dodecahydro-2'H,17'H-spiro[pyran-2,13'-[11,15]methano[1,5]dioxacyclooctadecino[9,8,7-cd]benzofuran]-17'-one

Storage Temperature

-18°C

Shipping Temperature

Room Temperature

Country of Origin

GERMANY

Transport Restrictions

Cargo Aircaft Only Air Excepted Air Dangerous

Tariff Code

29419000

Product Format

Neat