C47H60N7O1P GUANOSINE, 5 ′ -O- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -o- (2- methoxyethyl) -n- -n- (2-methyl-1-oxopropyl)-, 3 ′-[2-cishyl (n, n, n, ne-b-b-b-b-b-b-b-b-b-b-b-b-B-b-bylethyl
Rhif Cofrestrfa CAS
251647-55-9
H302
Priodweddau Ffisegol Allweddol | Gwerthfawrogom | Cyflyrasoch |
Pwysau moleciwlaidd | 914.00 | - |
PKA (a ragwelir) | 9.16 ± 0.20 | Mwyaf Temp Asidig: 25 ° C. |
Gwenau canonaidd
N#CCCOP (OC1C (OC (N2C = NC = 3C (= O) N = C (NC (= O) C (C) NC32) C1OCCOC) COC (C = 4C = CC = CC = CC4) (C5 = CC = C (oc) C) c
Gwenau isomerig
C (OC [C @@ H] 1 [c @@ H] (op (n (c (c (c) c) c (c) c) occc#n) [c @@ h] (occoc) [c @@ h] (o1) n2c3 = c (n = c2) c (= o) n = c (nc (c) = c) = o) (c) (c) (c) (c) (c) (c) (c) (c) (c) = (OC) C = C4) (C5 = CC = C (OC) C = C5) C6 = CC = CC = C6
Inchi
Inchi = 1S/C47H60N7O10P/C1-30 (2) 43 (55) 51-46-50-42-39 (44 (56) 52-46) 49-29-53 (42) 45-41 (60-27-26-5-26-27) 40 (62-66) 40 (62-27) 40 (62-27) 40 (62-26) 40 (62-27) 40 (62-27) 40 (62-26) 40 (62-27) 40 (62-26 31 (3) 4) 32 (5) 6) 38 (63-45) 28-61-47 (33-14-11-10-12-15-33,34-16-20-36 (58-8) 21-17-34) 35-18-22-37 (59-9-12,2121212,212 , 40-41,45H, 13,25-28H2,1-9H3, (H2,50,51,52,55,56)/T38-, 40-, 41-, 45-, 65?/M1/S1
Allwedd inchi
Ladcdgnebiqaau-sbcraqivsa-n
17 ENW arall ar gyfer y sylwedd hwn
Guanosine, 5 ′ -O-[bis (4-methoxyphenyl) phenylmethyl] -2 ′-O-(2-methoxyethyl)-N-(2-methyl-1-oxopropyl)-, 3 ′-[2-cyanoethyl bis (1- methylethyl) ffosfforamidite] (9Ci); 17: PN: US20030212017 Tudalen: 20 dilyniant honedig; 18: PN: US20030211606 Tudalen: 20
dilyniant hawlio; 19: PN: US20040005569 Tudalen: 22 Dilyniant honedig; 21: PN: US20040006030 Tudalen: 23 dilyniant honedig; 21: PN: US20040014047 Tudalen: 21 Dilyniant honedig; 21: PN: US20040014049 Tudalen: 21 Dilyniant honedig; 22: PN: US20030198965 PAG
E: 20 Dilyniant honedig; 22: PN: US20040005570 Tudalen: 21 Dilyniant Hawliedig; 22: PN: US20040014048 Tudalen: 21 Dilyniant honedig;
22: PN: US20040014050 Tudalen: 21 Dilyniant honedig; 23: PN: US20040005565 Tudalen: 17- 22 Dilyniant honedig; 23: PN: US20040
014051 Tudalen: 23 Dilyniant honedig; 24: PN: US20040014699 Tudalen: 21 Dilyniant honedig; 25: PN: US20040006029 Tudalen: 23 dilyniant honedig; 25: PN: WO03106645 Tudalen: 73 Dilyniant Hawliedig; 96: PN: US20040005707 Tudalen: 21 Dilyniant Hawliedig
Sbectra ar gael
13 C NMR
Hetero nmr
Eiddo ar gael
Biolegol
Gemegol
Lipinski
Strwythur yn gysylltiedig
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Ffactor Bio -ganolbwynt | 121 | Ph 1; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 2580 | Ph 2; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 23500 | Ph 3; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 71800 | Ph 4; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 89800 | Ph 5; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 92100 | Ph 6; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 91300 | Ph 7; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 82500 | Ph 8; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 42200 | Ph 9; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 7860 | Ph 10; TEMP: 25 ° C. | (1) ACD |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Koc | 164 | Ph 1; TEMP: 25 ° C. | (1) ACD |
Koc | 3480 | Ph 2; TEMP: 25 ° C. | (1) ACD |
Koc | 31700 | Ph 3; TEMP: 25 ° C. | (1) ACD |
Koc | 96900 | Ph 4; TEMP: 25 ° C. | (1) ACD |
Koc | 1.21 x 105 | Ph 5; TEMP: 25 ° C. | (1) ACD |
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Koc | 1.24 x 105 | Ph 6; TEMP: 25 ° C. | (1) ACD |
Koc | 1.23 x 105 | Ph 7; TEMP: 25 ° C. | (1) ACD |
Koc | 1.11 x 105 | Ph 8; TEMP: 25 ° C. | (1) ACD |
Koc | 56900 | Ph 9; TEMP: 25 ° C. | (1) ACD |
Koc | 10600 | Ph 10; TEMP: 25 ° C. | (1) ACD |
log | 3.95 | Ph 1; TEMP: 25 ° C. | (1) ACD |
log | 5.28 | Ph 2; TEMP: 25 ° C. | (1) ACD |
log | 6.24 | Ph 3; TEMP: 25 ° C. | (1) ACD |
log | 6.73 | Ph 4; TEMP: 25 ° C. | (1) ACD |
log | 6.82 | Ph 5; TEMP: 25 ° C. | (1) ACD |
log | 6.83 | Ph 6; TEMP: 25 ° C. | (1) ACD |
log | 6.83 | Ph 7; TEMP: 25 ° C. | (1) ACD |
log | 6.79 | Ph 8; TEMP: 25 ° C. | (1) ACD |
log | 6.50 | Ph 9; TEMP: 25 ° C. | (1) ACD |
log | 5.77 | Ph 10; TEMP: 25 ° C. | (1) ACD |
logio | 6.837 ± 0.764 | TEMP: 25 ° C. | (1) ACD |
Hydoddedd cynhenid torfol | 4.4 x 10-4 g/l | TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.34 g/l | Ph 1; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.016 g/l | Ph 2; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 1.7 x 10-3 g/l | Ph 3; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 5.7 x 10-4 g/l | Ph 4; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 4.6 x 10-4 g/l | Ph 5; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 4.4 x 10-4 g/l | Ph 6; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 4.5 x 10-4 g/l | Ph 7; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 4.9 x 10-4 g/l | Ph 8; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 1.0 x 10-3 g/l | Ph 9; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 5.2 x 10-3 g/l | Ph 10; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 4.5 x 10-4 g/l | Dŵr heb ei drin pH 6.99; TEMP: 25 ° C. | (1) ACD |
Hydoddedd cynhenid molar | 4.8 x 10-7 mol/l | TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 3.7 x 10-4 mol/l | Ph 1; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.7 x 10-5 mol/l | Ph 2; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.9 x 10-6 mol/l | Ph 3; TEMP: 25 ° C. | (1) ACD |
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Hydoddedd molar | 6.2 x 10-7 mol/l | Ph 4; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 5.0 x 10-7 mol/l | Ph 5; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 4.8 x 10-7 mol/l | Ph 6; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 4.9 x 10-7 mol/l | Ph 7; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 5.4 x 10-7 mol/l | Ph 8; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.1 x 10-6 mol/l | Ph 9; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 5.7 x 10-6 mol/l | Ph 10; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 4.9 x 10-7 mol/l | Dŵr heb ei drin pH 6.99; TEMP: 25 ° C. | (1) ACD |
Pwysau moleciwlaidd | 914.00 | ||
PKA | 9.16 ± 0.20 | Mwyaf Temp Asidig: 25 ° C. | (1) ACD |
PKA | 3.45 ± 0.70 | Temp mwyaf sylfaenol: 25 ° C. | (1) ACD |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Bondiau rotatable yn rhydd | 22 | (1) ACD | |
H Derbynyddion | 17 | (1) ACD | |
H rhoddwyr | 2 | (1) ACD | |
H rhoddwr/derbynnydd swm | 19 | (1) ACD | |
logio | 6.837 ± 0.764 | TEMP: 25 ° C. | (1) ACD |
Pwysau moleciwlaidd | 914.00 |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Eiddo | Gwerthfawrogom | Ffynhonnell Cyflwr |
Arwynebedd pegynol | 203 A2 | (1) ACD |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Sbectra ar gael
1 h nmr
13 C NMR
Ffynhonnell Datganiad Perygl Cod | |
H302 niweidiol os caiff ei lyncu | Dosbarthiad a Labelu Asiantaeth Gemegol Ewropeaidd (ECHA) Rhestr - Dosbarthiad a Labelu Hysbysedig - Hysbysiadau Mwyaf Cyffredin, Asiantaeth Gemegol Ewropeaidd (ECHA) Rhestr Dosbarthu a Labelu - Dosbarthiad a Labelu Hysbysedig - Hysbysiadau mwyaf difrifol |