CAS No.98474-78-3,Pseudoginsenoside RT5 Suppliers

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Basic Information

Molecular Structure:
CAS No.:	98474-78-3
Name:	Pseudoginsenoside RT5
Article Data:	2

Formula:	C₃₆H₆₂O₁₀
Molecular Weight:	654.882
Synonyms:	Dammarane,b-D-glucopyranoside deriv.;
Density:	1.279 g/cm³
Boiling Point:	759.532 °C at 760 mmHg
Flash Point:	413.15 °C
PSA:	169.30000
LogP:	2.50680

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Specification

The Pseudoginsenoside RT5, with the CAS registry number 98474-78-3, is also known as β-D-Glucopyranoside, (3β,6α,12β,24R)-20,24-epoxy-3,12,25-trihydroxydammaran-6-yl. It belongs to the product category of Ginsenoside Series. This chemical's molecular formula is C₃₆H₆₂O₁₀ and molecular weight is 654.88. What's more, its systematic name is called (3β,6α,12β,24R)-3,12,25-Trihydroxy-20,24-epoxydammaran-6-yl β-D-glucopyranoside.

Physical properties about Pseudoginsenoside RT5 are: (1)ACD/LogP: 2.181; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): 2.18; (4)ACD/LogD (pH 7.4): 2.18; (5)ACD/BCF (pH 5.5): 26.79; (6)ACD/BCF (pH 7.4): 26.79; (7)ACD/KOC (pH 5.5): 366.20; (8)ACD/KOC (pH 7.4): 366.20; (9)#H bond acceptors: 10; (10)#H bond donors: 7; (11)#Freely Rotating Bonds: 12; (12)Polar Surface Area: 169.3 Å²; (13)Index of Refraction: 1.588; (14)Molar Refractivity: 172.219 cm³; (15)Molar Volume: 511.868 cm³; (16)Polarizability: 68.273×10^-24 cm³; (17)Surface Tension: 60.36 dyne/cm; (18)Density: 1.279 g/cm³; (19)Flash Point: 413.15 °C; (20)Enthalpy of Vaporization: 126.202 kJ/mol; (21)Boiling Point: 759.532 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O[C@@H]6[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]6O[C@H]2C[C@@]1(C)[C@]4(C)CC[C@@H]([C@H]4[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)[C@@](C)(C)[C@H]23)[C@]5(C)CC[C@@H](O5)C(C)(C)O
(2) InChI: InChI=1S/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19+,20-,21+,22+,23-,24+,25-,26+,27-,28+,29-,30+,33+,34+,35+,36-/m0/s1
(3) InChIKey: PSOUXXNNRFNUAY-JLXGCTMESA-N