Common name
polyoxorim
Formula
C17H23N5O14
CAS
22976-86-9
IUPAC name
5-(2-amino-5-O-carbamoyl-2-deoxy-L-xylonamido)-1-(5-carboxy-1,2,3,4-tetrahydro-2,4-dioxopyrimidin-1-yl)-1,5-dideoxy-?-D-allofuranuronic acid
SMILES
c1c(c(nc(=O)n1[C@H]1[C@@H]([C@@H]([C@@H]([C@@H](C(=O)O)N=C([C@@H]([C@H]([C@@H](COC(=N)O)O)O)N)O)O1)O)O)O)C(=O)O
INCHI
InChI=1S/C17H23N5O14/c18-5(7(24)4(23)2-35-16(19)33)12(28)20-6(15(31)32)10-8(25)9(26)13(36-10)22-1-3(14(29)30)11(27)21-17(22)34/h1,4-10,13,23-26H,2,18H2,(H2,19,33)(H,20,28)(H,29,30)(H,31,32)(H,21,27,34)/t4-,5-,6+,7+,8+,9-,10-,13-/m1/s1
Physicochemical Properties
Molecular weight:
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Lipophilicity
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Water Solubility
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Geometric
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Electrostatic
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Flexibility
Num. Rot. bonds: 12
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AgroPAD
Photostability
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Topological
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Fungicide-likeness scores
The higher the score, the better the fungicide-likeness
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