C44H49N5O7Si Adenosine, N-Benzoyl-5'-O- [BIS (4-athoxyphenyl] -2''-O - (9CI, ACI)
Nga taonga tinana matua | Wāriu | Āhuatanga |
Taumaha Momo | 787.98 | - |
Te mutunga (tohua) | 1.23 ± 0.1 g / cm3 | TOM: 20 ° C; Press: 760 Torr |
PK (tohua) | 7.87 ± 0.43 | Te nuinga o te Opeware: 25 ° C |
Ataata cantical
O = c (nc1 = nc = nc2 = c1n = cn2c3oc (cc = cc = cc = cc = c (cc = c
Ataata isomeric
C (OC [C @ h] 1O [c @ h] ([c @ h] (c) c) (c) c) (c) c) n2c = 3c (n = c C (= o) c4 = cc = cc = c4) n = cn3) (c5 = c (oc = c5 = c6) c7 = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = c
Hapani
Inchi = 1s / C44H49N5O7SI / C1-43 (2,3) 57 (6,7) 57 (6,7) 35 (552-42 (38) 49-11) 49-11-10-8-11-10- 9) 26-54-44 (30-16-120,7-30,31-18-18-18-18-18-18-18-18-18-18-18-18-18 (52-44-34 (52-44-34 (53-5) 25-21-32 / H8-28,50,37h3,
45,46,48,48,51) / T35-, 37-, 38- / M1 / S1
Inchi Key
Dazigopiasnjpcj-gnecsjiwsa-n
2 etahi atu ingoa mo tenei taonga
N-Benzoyl-5'-o- BIS (4-athoxyphenyl) phenylmethyl] -2''-O - [(1,1-dimethylethyl] dimethylssilyl] adenosine (aci); N6-Benzoyl-5'-O- (4,4''- dimethoxytrityl) -2'-o- (Tert-ButylldimentyLsilyl) Adenosine
E waatea ana te Spectra
1h nmr
Hetero NMR
Nga Taonga e waatea ana |
Pāpori |
Matū |
Tōnu |
Lipinski |
Hanganga |
Pāpori
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te take koiora | 1.00 x 106 | Ph 1; Top: 25 ° C | (1) ACD |
Te take koiora | 1.00 x 106 | ph 2; Top: 25 ° C | (1) ACD |
Te take koiora | 1.00 x 106 | wh 3; Top: 25 ° C | (1) ACD |
Te take koiora | 1.00 x 106 | ph 4; Top: 25 ° C | (1) ACD |
Te take koiora | 1.00 x 106 | A 5; Top: 25 ° C | (1) ACD |
Te take koiora | 1.00 x 106 | ph 6; Top: 25 ° C | (1) ACD |
Te take koiora | 1.00 x 106 | A 7; Top: 25 ° C | (1) ACD |
Te take koiora | 1.00 x 106 | A 8; Top: 25 ° C | (1) ACD |
Te take koiora | 1.00 x 106 | A 9; Top: 25 ° C | (1) ACD |
Te take koiora | 5.41 x 105 | 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 | 2.01 x 106 | Ph 1; Top: 25 ° C | (1) ACD |
Hononga | 6.87 x 106 | ph 2; Top: 25 ° C | (1) ACD |
Hononga | 9.08 x 106 | wh 3; Top: 25 ° C | (1) ACD |
Hononga | 9.38 x 106 | ph 4; Top: 25 ° C | (1) ACD |
Hononga | 9.39 x 106 | A 5; Top: 25 ° C | (1) ACD |
Hononga | 9.19 x 106 | ph 6; Top: 25 ° C | (1) ACD |
Hononga | 7.53 x 106 | A 7; Top: 25 ° C | (1) ACD |
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Hononga | 2.73 x 106 | A 8; Top: 25 ° C | (1) ACD |
Hononga | 4.48 x 105 | A 9; Top: 25 ° C | (1) ACD |
Hononga | 1.31 x 105 | ph 10; Top: 25 ° C | (1) ACD |
arotau | 9.62 | Ph 1; Top: 25 ° C | (1) ACD |
arotau | 10.15 | ph 2; Top: 25 ° C | (1) ACD |
arotau | 10.27 | wh 3; Top: 25 ° C | (1) ACD |
arotau | 10.29 | ph 4; Top: 25 ° C | (1) ACD |
arotau | 10.29 | A 5; Top: 25 ° C | (1) ACD |
arotau | 10.28 | ph 6; Top: 25 ° C | (1) ACD |
arotau | 10.19 | A 7; Top: 25 ° C | (1) ACD |
arotau | 9.75 | A 8; Top: 25 ° C | (1) ACD |
arotau | 8.97 | A 9; Top: 25 ° C | (1) ACD |
arotau | 8.43 | ph 10; Top: 25 ° C | (1) ACD |
arotau | 10.291 ± 0.708 | Top: 25 ° C | (1) ACD |
Ko te whakaraeraetanga o te papatipu | 1.1 x 10-6 g / l | Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 4.8 x 10-6 g / l | Ph 1; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1.4 x 10-6 g / l | ph 2; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1.1 x 10-6 g / l | wh 3; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1.0 x 10-6 g / l | ph 4; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1.0 x 10-6 g / l | A 5; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1.0 x 10-6 g / l | ph 6; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1.3 x 10-6 g / l | A 7; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 3.5 x 10-6 g / l | A 8; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 2.2 x 10-5 g / l | A 9; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 7.6 x 10-5 g / l | ph 10; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 1.3 x 10-6 g / l | Te wai koretake o te waea 7.00; Top: 25 ° C | (1) ACD |
Ko te ngoikoretanga o te kolarsic | 1.4 x 10-9 mol / l | Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 6.1 x 10-9 mol / l | Ph 1; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 1.8 x 10-9 mol / l | ph 2; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 1.4 x 10-9 mol / l | wh 3; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 1.3 x 10-9 mol / l | ph 4; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 1.3 x 10-9 mol / l | A 5; Top: 25 ° C | (1) ACD |
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te whakararatanga a Molar | 1.3 x 10-9 mol / l | ph 6; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 1.6 x 10-9 mol / l | A 7; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 4.5 x 10-9 mol / l | A 8; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 2.8 x 10-8 mol / l | A 9; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 9.6 x 10-8 mol / l | ph 10; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 1.6 x 10-9 mol / l | Te wai koretake o te waea 7.00; Top: 25 ° C | (1) ACD |
Taumaha Momo | 787.98 | ||
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 | 1.23 ± 0.1 g / cm3 | TOM: 20 ° C; Press: 760 Torr | (1) ACD |
Rōnga MOAR | 639.5 ± 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 | 14 | (1) ACD | |
H whakaae | 12 | (1) ACD | |
Ko nga putea | 2 | (1) ACD | |
H Donor / Whakaaetanga moni | 14 | (1) ACD | |
arotau | 10.291 ± 0.708 | Top: 25 ° C | (1) ACD |
Taumaha Momo | 787.98 |
(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 | 139 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