The Thevebioside is an organic compound with the formula C₃₆H₅₆O₁₃. The systematic name of this chemical is 3-[(6-deoxy-2-O-hexopyranosyl-3-O-methylhexopyranosyl)oxy]-14-hydroxycard-20(22)-enolide. With the CAS registry number 114586-47-9, it is also named as Graciloside.

Physical properties about Thevebioside are: (1)ACD/LogP: 1.17; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): 1.17; (4)ACD/LogD (pH 7.4): 1.17; (5)ACD/BCF (pH 5.5): 4.57; (6)ACD/BCF (pH 7.4): 4.57; (7)ACD/KOC (pH 5.5): 103.33; (8)ACD/KOC (pH 7.4): 103.33; (9)#H bond acceptors: 13; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 127.83 Å²; (13)Index of Refraction: 1.605; (14)Molar Refractivity: 173.6 cm³; (15)Molar Volume: 503.4 cm³; (16)Polarizability: 68.82×10^-24cm³; (17)Surface Tension: 66.4 dyne/cm; (18)Density: 1.38 g/cm³; (19)Flash Point: 263.4 °C; (20)Enthalpy of Vaporization: 141.52 kJ/mol; (21)Boiling Point: 856.7 °C at 760 mmHg; (22)Vapour Pressure: 3.49E-34 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C\1OC/C(=C/1)C2CCC7(O)C2(C)CCC6C7CCC5CC(OC4OC(C)C(O)C(OC)C4OC3OC(C(O)C(O)C3O)CO)CCC56C
(2)InChI: InChI=1/C36H56O13/c1-17-26(39)30(44-4)31(49-32-29(42)28(41)27(40)24(15-37)48-32)33(46-17)47-20-7-10-34(2)19(14-20)5-6-23-22(34)8-11-35(3)21(9-12-36(23,35)43)18-13-25(38)45-16-18/h13,17,19-24,26-33,37,39-43H,5-12,14-16H2,1-4H3
(3)InChIKey: NBMKMJSSZYZNRL-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C36H56O13/c1-17-26(39)30(44-4)31(49-32-29(42)28(41)27(40)24(15-37)48-32)33(46-17)47-20-7-10-34(2)19(14-20)5-6-23-22(34)8-11-35(3)21(9-12-36(23,35)43)18-13-25(38)45-16-18/h13,17,19-24,26-33,37,39-43H,5-12,14-16H2,1-4H3
(5)Std. InChIKey: NBMKMJSSZYZNRL-UHFFFAOYSA-N