C41h41n5o8 Edenesinen, N-Benzoyl-5'-O- [Bis (4-E- (9ci o- (
Thepa ea bohlokoa ea 'mele | Boleng | Boemo |
Boima ba Molecular | 731.79 | - |
Ntlha ea ho qhibiliha (liteko) | 119-121 ° C | - |
Mabenyane (a boletsoeng esale pele) | 1.31 ± 0.1 g / cm3 | Temp: 20 ° C; Tobetsa: 760 Torr |
pka (e boletsoeng esale pele) | 7.87 ± 0.43 | Boholo ba tempele ea acidic: 25 ° C |
Cannonical Smiles O = C (NC1 = NC1 = NC2 = CC4 = CCOCCOC) C = 7C = CC = CC = CC = CC = CC
Isomerica e bososela
C (OC 7 @ h] 1o [C @ h] ([C @ h] (
= C6) c7 = cc = cc = c7
Inchi
Inchi = 1s / c41h41n5o8 / c1-42-22-23-5 (44-45-44-30) 41 (28-12-8-8-9-9-13-28,29-18-18-30 19-15-29) 30-15-26,3353, 22- 353, (H, 42,45,45,45,45,45,45-, 35-, 35- / M1 / S1 / S1 / S1
Senotlolo sa Inchi
Kevmxgndtkmppsmc-mumpvmasa-n
Mabitso a mang a 16 bakeng sa ntho ena
N-Benzoyl-5'-o- [Bis (4-Met (4-Met (4-Met (4-Meth 17: PN :: US20030211106 Leqephe la 19 18: Pn: PN: US20040005569. 22 20: PN: US20040006060033: 23 e tummeng; 20: PN: US200400147 Leqephe: 21 Tse tummeng 20: Pn: US200400149 Leqephe: 21 Tse tummeng 21: PN: US20040005570 pag
E: 20 tse fetileng tsa tatellano; 21 Pn: PN: US200400148 Leqephe: 21 tse tummeng; 21 Pn: PN: US20040014050 Leqephe: Liquisined 22: Pn: PN: US20040005565 LEQEPHES: 176 22: PN: US2004001400000000000 23: Pn: US20040440 014699 014699 014699 014699. 24: Pn: PN: US2004000606002999 Leqephe la 23 le bolailoe ke tatellano; 24: PN: Leqephe la Wo03106645 Leqephe: 73 e bolailoe ke tatellano; 5'-Dimberthoxytharll-2'-o- (2-the Memoxethyl) -N-benzoyl adenosine; 95: Pn: PN: US20040005707 leqepheng la: 20 Tsebo
Thepa e fumanehang |
Armal |
Armal
Thepa | Boleng | Boemo | Mohloli |
Ntlha ea ho qhibiliha | 119-121 ° C | (1) cas |
(1) Ponjarla, Srishylam. Li-nucleosides
Spectra e fumanehang
1h nmr
13c nmr
Thepa e fumanehang |
Sa tlhaho |
Lik'hemik'hale |
Letsoalo |
LIPINSSKI |
Sebopeho se amanang le |
Sa tlhaho
Thepa | Boleng | Boemo | Mohloli |
Linkho tsa BioCentration | 31700 | ph 1; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 1.08 x 105 | ph 2; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 1.43 x 105 | ph 3; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 1.48 x 105 | PH 4; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 1.48 x 105 | ph 5; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 1.45 x 105 | PH 6; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 1.19 x 105 | PH 7; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 43000 | PH 8; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 7050 | ph 9; TEMP: 25 ° C | (1) ACD |
Thepa | Boleng | Boemo | Mohloli |
Linkho tsa BioCentration | 2060 | ph 10; TEMP: 25 ° C | (1) ACD |
.
Lik'hemik'hale
Thepa | Boleng | Boemo | Mohloli |
Koc | 37400 | ph 1; TEMP: 25 ° C | (1) ACD |
Koc | 1.28 x 105 | ph 2; TEMP: 25 ° C | (1) ACD |
Koc | 1.69 x 105 | ph 3; TEMP: 25 ° C | (1) ACD |
Koc | 1.74 x 105 | PH 4; TEMP: 25 ° C | (1) ACD |
Koc | 1.74 x 105 | ph 5; TEMP: 25 ° C | (1) ACD |
Koc | 1.71 x 105 | PH 6; TEMP: 25 ° C | (1) ACD |
Koc | 1.40 x 105 | PH 7; TEMP: 25 ° C | (1) ACD |
Koc | 50700 | PH 8; TEMP: 25 ° C | (1) ACD |
Koc | 8320 | ph 9; TEMP: 25 ° C | (1) ACD |
Koc | 2430 | ph 10; TEMP: 25 ° C | (1) ACD |
logd | 6.44 | ph 1; TEMP: 25 ° C | (1) ACD |
logd | 6.97 | ph 2; TEMP: 25 ° C | (1) ACD |
logd | 7.09 | ph 3; TEMP: 25 ° C | (1) ACD |
logd | 7.11 | PH 4; TEMP: 25 ° C | (1) ACD |
logd | 7.11 | ph 5; TEMP: 25 ° C | (1) ACD |
logd | 7.10 | PH 6; TEMP: 25 ° C | (1) ACD |
logd | 7.01 | PH 7; TEMP: 25 ° C | (1) ACD |
logd | 6.57 | PH 8; TEMP: 25 ° C | (1) ACD |
logd | 5.78 | ph 9; TEMP: 25 ° C | (1) ACD |
logd | 5.25 | ph 10; TEMP: 25 ° C | (1) ACD |
Logp | 7.109 ± 0.766 | TEMP: 25 ° C | (1) ACD |
Mass Interrincic solubility | 5.6 x 10-6 g / l | TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 2.6 x 10-5 g / l | ph 1; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 7.3 x 10-6 g / l | ph 2; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 5.8 x 10-6 g / l | ph 3; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 5.6 x 10-6 g / l | PH 4; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 5.6 x 10-6 g / l | ph 5; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 5.7 x 10-6 g / l | PH 6; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 7.0 x 10-6 g / l | PH 7; TEMP: 25 ° C | (1) ACD |
Thepa | Boleng | Boemo | Mohloli |
Mass Slisedity | 1.9 x 10-5 g / l | PH 8; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 1.2 x 10-4 g / l | ph 9; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 4.0 x 10-4 g / l | ph 10; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 7.0 x 10-6 g / l | Ph ea metsi e sa sebetsoeng 7.00; TEMP: 25 ° C | (1) ACD |
Molala oa Molala oa Molala | 7.6 x 10-9 Mol / L | TEMP: 25 ° C | (1) ACD |
Molala ea lla | 3.6 x 10-8 MOL / L | ph 1; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.0 x 10-8 MOL / L | ph 2; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 7.9 x 10-9 Mol / L | ph 3; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 7.7 x 10-9 Mol / L | PH 4; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 7.7 x 10-9 Mol / L | ph 5; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 7.8 x 10-9 Mol / L | PH 6; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 9.6 x 10-9 Mol / L | PH 7; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 2.6 x 10-8 MOL / L | PH 8; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.6 x 10-7 Mol / L | ph 9; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 5.5 x 10-7 Mol / L | ph 10; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 9.5 x 10-9 Mol / L | Ph ea metsi e sa sebetsoeng 7.00; TEMP: 25 ° C | (1) ACD |
Boima ba Molecular | 731.79 | ||
pka | 7.87 ± 0.43 | Boholo ba tempele ea acidic: 25 ° C | (1) ACD |
pka | 1.39 ± 0.10 | Boholo ba mosebetsi oa mantlha: 25 ° C | (1) ACD |
.
Letsoalo
Thepa | Boleng | Boemo | Mohloli |
Letsoalo | 1.31 ± 0.1 g / cm3 | Temp: 20 ° C; Tobetsa: 760 Torr | (1) ACD |
Molumo oa Molalar | 556.9 ± 7.0 cm3 / mol | Temp: 20 ° C; Tobetsa: 760 Torr | (1) ACD |
.
LIPINSSKI
Thepa | Boleng | Boemo | Mohloli |
Li-litlama tse potolohileng ka bolokolohi | 15 | (1) ACD | |
H | 13 | (1) ACD | |
H donors | 2 | (1) ACD | |
H donor / Canot | 15 | (1) ACD | |
Thepa | Boleng | Boemo | Mohloli |
Logp | 7.109 ± 0.766 | TEMP: 25 ° C | (1) ACD |
Boima ba Molecular | 731.79 |
.
Sebopeho se amanang le
Thepa | Boleng | Boemo | Mohloli |
Sebaka sa polar. | 148 A2 | (1) ACD |
.
Spectra e fumanehang
1h nmr
13c nmr