C41h41n5o8 Adenosine, N-Benzoyl-5'-O- A- BIS (4-METOXYPHYL) Phenylmethyl] -2'- O- 2-ACI, ACI)
Nga taonga tinana matua | Wāriu | Āhuatanga |
Taumaha Momo | 731.79 | - |
Rewa te wāhi (whakamātautau) | 119-121 ° C | - |
Te mutunga (tohua) | 1.31 ± 0.1 G / CM3 | TOM: 20 ° C; Press: 760 Torr |
PK (tohua) | 7.87 ± 0.43 | Te nuinga o te Opeware: 25 ° C |
SMILSICAL CLAMES O = C (NC1 = NC1 = NC2 = CN2CH3OC (CC = cc = cc = cc = c5 = c6) c = c6
Ataata isomeric
C (OC [C @ h] 1O [C @ h] (@. cc = cc = cc = c5 = c
= C6) c7 = cc = cc = c7
Hapani
Inchi = 1s / c41h41n5o8 / C1-49-22-23-52-36 (47) 33 (54-20-40 (364-6-40 (34) 46-39 (48) 27-10-6-49) 24-53-7) 24-53 41 (28-12-8-5-9-13-28-13-28-13-28-18-18-18-18-18 (50-21-11 (50-219) 30-15-20-32 (51-30-32 (H45-36,40,3H2,1-3H3, 22-24H2,1-3H3, (H, 42,43,45,48) / T33-, 35-, 36-, 40- / M1 / S1
Inchi Key
KevmxgndtKpsmc-Mumpvvmasa-n
16 etahi atu ingoa mo tenei taonga
N-Benzoyl-5'-o- BIS (4-athoxyphenyl) phenylmethyl] -2''-o- (2-athoxyetyl) Adenosine (aci); 17: PN: US200302111606 Whārangi: 19 raupapa kereme; 18: PN: US200400055569 Whārangi: 22 raupapa kereme; 20: PN: US20040006030 Whārangi: 23 raupapa kereme; 20: PN: US2004001474 Whārangi: 21 Kua kereme; 20: PN: US2004001499 Whārangi: 21 Kua kereme; 21: PN: US200400055570 PAG
E: 20 raupapa kereme; 21: PN: US20040014048 Whārangi: 21 Kua kereme; 21: PN: US20040014050 Whārangi: 20 raupapa kereme; 22: PN: US200400055565 Whārangi: 17- 22 raupapa kereme; 22: PN: US20040014051 Whārangi: 23 raupapa kereme; 23: PN: US20040 014699 Whārangi: 20 raupapa kereme; 24: PN: US20040006029 Whārangi: 23 raupapa kereme; 24: PN: PN: WO0310645 Whārangi: 73 raupapa kereme; 5'-dimethoxytrityl-2'-o- (2-athoxyethyl) -n6-benzoyl adenosine; 95: PN: US20040005707 Whārangi: 20 raupapa kereme
Nga Taonga e waatea ana |
Thermal |
Thermal
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Hanumi wāhi | 119-121 ° C | (1) cas |
(1) Penjarla, Srishylam; Nukuhia, Nihokikorangi me te waikawa kūpapa, (2018), 37 (4), 232-247, Caplus
E waatea ana te Spectra
1h nmr
13c nmr
Nga Taonga e waatea ana |
Pāpori |
Matū |
Tōnu |
Lipinski |
Hanganga |
Pāpori
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te take koiora | 31700 | Ph 1; Top: 25 ° C | (1) ACD |
Te take koiora | 1.08 x 105 | ph 2; Top: 25 ° C | (1) ACD |
Te take koiora | 1.43 x 105 | wh 3; Top: 25 ° C | (1) ACD |
Te take koiora | 1.48 x 105 | ph 4; Top: 25 ° C | (1) ACD |
Te take koiora | 1.48 x 105 | A 5; Top: 25 ° C | (1) ACD |
Te take koiora | 1.45 x 105 | ph 6; Top: 25 ° C | (1) ACD |
Te take koiora | 1.19 x 105 | A 7; Top: 25 ° C | (1) ACD |
Te take koiora | 43000 | A 8; Top: 25 ° C | (1) ACD |
Te take koiora | 7050 | A 9; Top: 25 ° C | (1) ACD |
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te take koiora | 2060 | ph 10; Top: 25 ° C | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Matū
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Hononga | 37400 | Ph 1; Top: 25 ° C | (1) ACD |
Hononga | 1.28 x 105 | ph 2; Top: 25 ° C | (1) ACD |
Hononga | 1.69 x 105 | wh 3; Top: 25 ° C | (1) ACD |
Hononga | 1.74 x 105 | ph 4; Top: 25 ° C | (1) ACD |
Hononga | 1.74 x 105 | A 5; Top: 25 ° C | (1) ACD |
Hononga | 1.71 x 105 | ph 6; Top: 25 ° C | (1) ACD |
Hononga | 1.40 x 105 | A 7; Top: 25 ° C | (1) ACD |
Hononga | 50700 | A 8; Top: 25 ° C | (1) ACD |
Hononga | 8320 | A 9; Top: 25 ° C | (1) ACD |
Hononga | 2430 | ph 10; Top: 25 ° C | (1) ACD |
arotau | 6.44 | Ph 1; Top: 25 ° C | (1) ACD |
arotau | 6.97 | ph 2; Top: 25 ° C | (1) ACD |
arotau | 7.09 | wh 3; Top: 25 ° C | (1) ACD |
arotau | 7.11 | ph 4; Top: 25 ° C | (1) ACD |
arotau | 7.11 | A 5; Top: 25 ° C | (1) ACD |
arotau | 7.10 | ph 6; Top: 25 ° C | (1) ACD |
arotau | 7.01 | A 7; Top: 25 ° C | (1) ACD |
arotau | 6.57 | A 8; Top: 25 ° C | (1) ACD |
arotau | 5.78 | A 9; Top: 25 ° C | (1) ACD |
arotau | 5.25 | ph 10; Top: 25 ° C | (1) ACD |
arotau | 7.109 ± 0.766 | Top: 25 ° C | (1) ACD |
Ko te whakaraeraetanga o te papatipu | 5.6 x 10-6 g / l | Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 2.6 x 10-5 g / l | Ph 1; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 7.3 x 10-6 g / l | ph 2; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 5.8 x 10-6 g / l | wh 3; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 5.6 x 10-6 g / l | ph 4; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 5.6 x 10-6 g / l | A 5; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 5.7 x 10-6 g / l | ph 6; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 7.0 x 10-6 g / l | A 7; Top: 25 ° C | (1) ACD |
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te whakarewa papatipu | 1.9 x 10-5 g / l | A 8; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1.2 x 10-4 g / l | A 9; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 4.0 x 10-4 g / l | ph 10; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 7.0 x 10-6 g / l | Te wai koretake o te waea 7.00; Top: 25 ° C | (1) ACD |
Ko te ngoikoretanga o te kolarsic | 7.6 x 10-9 mol / l | Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 3.6 x 10-8 mol / l | Ph 1; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 1.0 x 10-8 mol / l | ph 2; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 7.9 x 10-9 mol / l | wh 3; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 7.7 x 10-9 mol / l | ph 4; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 7.7 x 10-9 mol / l | A 5; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 7.8 x 10-9 mol / l | ph 6; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 9.6 x 10-9 mol / l | A 7; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 2.6 x 10-8 mol / l | A 8; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 1.6 x 10-7 mol / l | A 9; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 5.5 x 10-7 mol / l | ph 10; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 9.5 x 10-9 mol / l | Te wai koretake o te waea 7.00; Top: 25 ° C | (1) ACD |
Taumaha Momo | 731.79 | ||
pāt | 7.87 ± 0.43 | Te nuinga o te Opeware: 25 ° C | (1) ACD |
pāt | 1.39 ± 0.10 | Te tino tauira taketake: 25 ° C | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Tōnu
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Tōnu | 1.31 ± 0.1 G / CM3 | TOM: 20 ° C; Press: 760 Torr | (1) ACD |
Rōnga MOAR | 556.9 ± 7.0 cm3 / mol | TOM: 20 ° C; Press: 760 Torr | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Lipinski
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Nga here hurihuri noa | 15 | (1) ACD | |
H whakaae | 13 | (1) ACD | |
Ko nga putea | 2 | (1) ACD | |
H Donor / Whakaaetanga moni | 15 | (1) ACD | |
Rawa | Wāriu | Āhuatanga | Mātāpuna |
arotau | 7.109 ± 0.766 | Top: 25 ° C | (1) ACD |
Taumaha Momo | 731.79 |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Hanganga
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te rohe mata o te polar | 148 A2 | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
E waatea ana te Spectra
1h nmr
13c nmr