| Specification: |
This chemical is called (S)-Ginsenoside Rh2, and its systematic name is (3β,12β)-12,20-dihydroxydammar-24-en-3-yl β-D-glucopyranoside. With the molecular formula of C36H62O8, its molecular weight is 622.87. The CAS registry number of this chemical is 67400-17-3. In addition, the product Categories of the (S)-Ginsenoside Rh2 are Ginsenoside Series.
Other characteristics of the (S)-Ginsenoside Rh2 can be summarised as followings: (1)ACD/LogP: 5.62; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): 5.62; (4)ACD/LogD (pH 7.4): 5.62; (5)ACD/BCF (pH 5.5): 10969.9; (6)ACD/BCF (pH 7.4): 10969.83; (7)ACD/KOC (pH 5.5): 27137.27; (8)ACD/KOC (pH 7.4): 27137.09; (9)#H bond acceptors: 8; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 73.84 Å2; (13)Index of Refraction: 1.571; (14)Molar Refractivity: 170.7 cm3; (15)Molar Volume: 519.1 cm3; (16)Polarizability: 67.67×10-24cm3; (17)Surface Tension: 54.5 dyne/cm; (18)Density: 1.19 g/cm3; (19)Flash Point: 393.1 °C; (20)Enthalpy of Vaporization: 121.13 kJ/mol; (21)Boiling Point: 726.4 °C at 760 mmHg; (22)Vapour Pressure: 2.31E-24 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O([C@@H]2C(C)(C)[C@@H]3CC[C@@]1(C)[C@]4(C)CC[C@H]([C@](O)(C)CC\C=C(/C)C)[C@H]4[C@H](O)C[C@@H]1[C@@]3(C)CC2)[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)CO
(2)InChI: InChI=1/C36H62O8/c1-20(2)10-9-14-36(8,42)21-11-16-35(7)27(21)22(38)18-25-33(5)15-13-26(32(3,4)24(33)12-17-34(25,35)6)44-31-30(41)29(40)28(39)23(19-37)43-31/h10,21-31,37-42H,9,11-19H2,1-8H3/t21-,22+,23+,24-,25+,26-,27-,28+,29-,30+,31-,33-,34+,35+,36-/m0/s1
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