Deoxynivalenol 3-glucoside solution
[CAS# 131180-21-7]

Identification

• Name: Deoxynivalenol 3-glucoside solution
• Molecular Formula: C₂₁H₃₀O₁₁
• Molecular Weight: 458.46
• CAS Registry Number: 131180-21-7
• SMILES: [C@@H]2(C[C@]3(C)[C@@]1(CO)[C@H](C(C(=C[C@H]1O[C@H]2C34CO4)C)=O)O)O[C@H]5[C@H](O)[C@@H](O)[C@H](O)[C@H](O5)CO
• InChI: 1S/C21H30O11/c1-8-3-11-20(6-23,16(28)12(8)24)19(2)4-9(17(32-11)21(19)7-29-21)30-18-15(27)14(26)13(25)10(5-22)31-18/h3,9-11,13-18,22-23,25-28H,4-7H2,1-2H3/t9-,10+,11+,13+,14-,15+,16-,17+,18+,19+,20+,21?/m0/s1
• InChIKey: PUMXWMGECQIOGB-VNWPYRAQSA-N

Properties

• Density: 1.61g/cm³ (Cal.)
• Boiling point: 731.09°C at 760 mmHg (Cal.)
• Flash point: 255.401°C (Cal.)