| Identification | |
| Name: | 24,25,26-Trinoroleanan-3-ol,5,9,13-trimethyl-, (3b,4b,5b,8a,9b,10a,13a,14b)- |
| Synonyms: | D:A-Friedooleanan-3-ol,(3b)-;D:A-Friedooleanan-3b-ol (7CI,8CI);3-Epifriedelinol;3-epi-Friedanol;3b-Hydroxyfriedelane;Epifriedelanol;Epifriedelinol;Friedelan-3b-ol;Friedelin-3b-ol;Longan triterpane A;epi-Friedelanol;b-Friedelinol; |
| CAS: | 16844-71-6 |
| Molecular Formula: | C30H52O |
| Molecular Weight: | 428.73 |
| InChI: | InChI=1/C30H52O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20-24,31H,9-19H2,1-8H3/t20-,21-,22+,23-,24+,26+,27+,28-,29+,30-/m0/s1 |
| Molecular Structure: |  |
| Properties | |
| Density: | 0.966 g/cm3 |
| Refractive index: | 1.508 |
| Specification: |
The Epifriedelanol with the CAS number 16844-71-6 is also called 3b-Hydroxyfriedelane. The IUPAC name is (3R,4R,4aS,6aS,6aS,6bR,8aR,12aR,14aS,14bS)-4,4a,6a,6b,8a,11,11,14a-octamethyl-1,2,3,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-hexadecahydropicen-3-ol. Its molecular formula is C30H52O. The product category is Miscellaneous Natural Products. The properties of the Epifriedelanol are: (1)ACD/LogP: 11.45; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 11.45; (4)ACD/LogD (pH 7.4): 11.45; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.508; (14)Molar Refractivity: 132.33 cm3; (15)Molar Volume: 443.4 cm3; (16)Polarizability: 52.46×10-24cm3; (17)Surface Tension: 37.4 dyne/cm; (18)Enthalpy of Vaporization: 85.56 kJ/mol; (19)Vapour Pressure: 3.71×10-11 mmHg at 25°C. You can still convert the following datas into molecular structure: |
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