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| CAS No.: | 78574-94-4 |
|---|---|
| Name: | CYCLOASTRAGENOL |
| Article Data: | 31 |
| Molecular Structure: | |
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| Formula: | C30H50O5 |
| Molecular Weight: | 490.724 |
| Synonyms: | Astramembrangenin;Cycloastragenol;Cyclosieversigenin; |
| Density: | 1.2 g/cm3 |
| Melting Point: | 241.0 to 245.0 °C |
| Boiling Point: | 617.174 °C at 760 mmHg |
| Flash Point: | 327.055 °C |
| PSA: | 90.15000 |
| LogP: | 4.43660 |
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Specification
The Cyclosiversigenin, with the CAS registry number 78574-94-4, is also known as Cycloastragenol. This chemical's molecular formula is C30H50O5 and molecular weight is 490.71. What's more, its systematic name is (3β,6α,9β,16β,20R,24S)-20,24-Epoxy-9,19-cyclolanostane-3,6,16,25-tetrol. This chemical is a sapogenin found in or derived from Astragalus membranaceus. It seems to moderately increase telomerase activity and proliferative capacity in both CD4 and CD8 T cells in in vitro experiments.
Physical properties of Cyclosiversigenin are: (1)ACD/LogP: 3.821; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.82; (4)ACD/LogD (pH 7.4): 3.82; (5)ACD/BCF (pH 5.5): 471.72; (6)ACD/BCF (pH 7.4): 471.72; (7)ACD/KOC (pH 5.5): 2853.80; (8)ACD/KOC (pH 7.4): 2853.80; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 90.15 Å2; (13)Index of Refraction: 1.582; (14)Molar Refractivity: 136.488 cm3; (15)Molar Volume: 408.839 cm3; (16)Polarizability: 54.108×10-24cm3; (17)Surface Tension: 53.0 dyne/cm; (18)Density: 1.2 g/cm3; (19)Flash Point: 327.055 °C; (20)Enthalpy of Vaporization: 104.945 kJ/mol; (21)Boiling Point: 617.174 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(O)[C@@H]1CC[C@@](C)(O1)[C@H]3[C@@H](O)C[C@@]2(C)[C@@H]4C[C@H](O)[C@H]6[C@](C)(C)[C@@H](O)CC[C@@]65C[C@@]45CC[C@@]23C
(2)Std. InChI: InChI=1S/C30H50O5/c1-24(2)20(33)8-11-30-16-29(30)13-12-26(5)23(28(7)10-9-21(35-28)25(3,4)34)18(32)15-27(26,6)19(29)14-17(31)22(24)30/h17-23,31-34H,8-16H2,1-7H3/t17-,18-,19-,20-,21-,22-,23-,26+,27-,28+,29-,30+/m0/s1
(3)Std. InChIKey: WENNXORDXYGDTP-UOUCMYEWSA-N