3-acetyl deoxynivalenol

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InChI :InChI=1/C17H22O7/c1-8-4-11-16(6-18,13(21)12(8)20)15(3)5-10(23-9(2)19)14(24-11)17(15)7-22-17/h4,10-11,13-14,18,21H,5-7H2,1-3H3
Std.InChI: InChI=1S/C17H22O7/c1-8-4-11-16(6-18,13(21)12(8)20)15(3)5-10(23-9(2)19)14(24-11)17(15)7-22-17/h4,10-11,13-14,18,21H,5-7H2,1-3H3
InChIKey :ADFIQZBYNGPCGY-UHFFFAOYAZ
Std.InChIKey: ADFIQZBYNGPCGY-UHFFFAOYSA-N
SMILES :O=C4\C(=C/C3OC2C1(OC1)C(CC2OC(=O)C)(C3(CO)C4O)C)C
MDL: MFCD00135964
Molar Refractivity :80.73 ± 0.4 cm3 (est)
Parachor :662.9 ± 6.0 cm3 (est)
Index of Refraction :1.595 ± 0.03 (est)
Surface Tension :60.7 ± 5.0 dyne/cm (est)
Density :1.42 ± 0.1 g/cm3 (est)
Polarizability :32.00 ± 0.5 10-24cm3 (est)