C15H21N5O6 Guanosine, 2'-O-Methyl-N- (2-methyl-1-oxopropyl)-(9CI, ACI)
Priodweddau Ffisegol Allweddol | Gwerthfawrogom | Cyflyrasoch |
Pwysau moleciwlaidd | 367.36 | - |
Dwysedd (a ragwelir) | 1.68 ± 0.1 g/cm3 | Temp: 20 ° C; Gwasg: 760 Torr |
PKA (a ragwelir) | 9.16 ± 0.20 | Mwyaf Temp Asidig: 25 ° C. |
Gwên Canonaidd O = C1N = C (NC (= O) C (C) C) NC2 = C1N = CN2C3OC (CO) C (O) C3OC
Gwenau isomerig o (c) [c@h] 1 [c@h] (n2c3 = c (n = c2) c (= o) n = c (nc (c (c) c) = o) n3) o [c@h] (co) [c@h] 1o
Inchi
Inchi = 1s/c15h21n5o6/c1-6 (2) 12 (23) 18-15-17-11-8 (13 (24) 19-15) 16-5-20 (11) 14-10 (25-3) 9 (22) 7 (4-21) 26-14/h5-7,9-10,14,21------1-1---------21----------22---------1--------1---------1-1---------1----------11-- 22H, 4H2,1-3H3, (H2,17,18,19,23,24)/T7-, 9-, 10-, 14-/M1/S1
Allwedd inchi
Rpulcyxeyodqog-akaijsegsa-n
2 enw arall ar gyfer y sylwedd hwn
2'-O-Methyl-N-(2-methyl-1-oxopropyl) guanosine (ACI);N2-isobutyryl-2'--O-methylguanosine
Sbectra ar gael
1h nmr
13c nmr
Torfol
Eiddo ar gael |
Biolegol |
Gemegol |
Ddwysedd |
Lipinski |
Strwythur yn gysylltiedig |
Biolegol
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Ffactor Bio -ganolbwynt | 1.0 | Ph 1; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 2; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 3; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 4; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 5; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 6; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 7; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 8; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 9; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | 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)
Gemegol
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Koc | 2.12 | Ph 1; TEMP: 25 ° C. | (1) ACD |
Koc | 8.67 | Ph 2; TEMP: 25 ° C. | (1) ACD |
Koc | 12.6 | Ph 3; TEMP: 25 ° C. | (1) ACD |
Koc | 13.3 | Ph 4; TEMP: 25 ° C. | (1) ACD |
Koc | 13.3 | Ph 5; TEMP: 25 ° C. | (1) ACD |
Koc | 13.3 | Ph 6; TEMP: 25 ° C. | (1) ACD |
Koc | 13.2 | Ph 7; TEMP: 25 ° C. | (1) ACD |
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Koc | 12.5 | Ph 8; TEMP: 25 ° C. | (1) ACD |
Koc | 7.85 | Ph 9; TEMP: 25 ° C. | (1) ACD |
Koc | 1.76 | Ph 10; TEMP: 25 ° C. | (1) ACD |
log | -1.26 | Ph 1; TEMP: 25 ° C. | (1) ACD |
log | -0.65 | Ph 2; TEMP: 25 ° C. | (1) ACD |
log | -0.49 | Ph 3; TEMP: 25 ° C. | (1) ACD |
log | -0.47 | Ph 4; TEMP: 25 ° C. | (1) ACD |
log | -0.46 | Ph 5; TEMP: 25 ° C. | (1) ACD |
log | -0.46 | Ph 6; TEMP: 25 ° C. | (1) ACD |
log | -0.47 | Ph 7; TEMP: 25 ° C. | (1) ACD |
log | -0.49 | Ph 8; TEMP: 25 ° C. | (1) ACD |
log | -0.69 | Ph 9; TEMP: 25 ° C. | (1) ACD |
log | -1.34 | Ph 10; TEMP: 25 ° C. | (1) ACD |
logio | -0.464 ± 0.636 | TEMP: 25 ° C. | (1) ACD |
Hydoddedd cynhenid torfol | 0.55 g/l | TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 3.5 g/l | Ph 1; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.84 g/l | Ph 2; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.59 g/l | Ph 3; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.55 g/l | Ph 4; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.55 g/l | Ph 5; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.55 g/l | Ph 6; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.55 g/l | Ph 7; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.59 g/l | Ph 8; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.96 g/l | Ph 9; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 4.4 g/l | Ph 10; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.55 g/l | Dŵr heb ei drin pH 6.00; TEMP: 25 ° C. | (1) ACD |
Hydoddedd cynhenid molar | 1.5 x 10-3 mol/l | TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 9.6 x 10-3 mol/l | Ph 1; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 2.3 x 10-3 mol/l | Ph 2; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.6 x 10-3 mol/l | Ph 3; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.5 x 10-3 mol/l | Ph 4; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.5 x 10-3 mol/l | Ph 5; TEMP: 25 ° C. | (1) ACD |
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Hydoddedd molar | 1.5 x 10-3 mol/l | Ph 6; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.5 x 10-3 mol/l | Ph 7; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.6 x 10-3 mol/l | Ph 8; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 2.6 x 10-3 mol/l | Ph 9; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 0.012 mol/l | Ph 10; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.5 x 10-3 mol/l | Dŵr heb ei drin pH 6.00; TEMP: 25 ° C. | (1) ACD |
Pwysau moleciwlaidd | 367.36 | ||
PKA | 9.16 ± 0.20 | Mwyaf Temp Asidig: 25 ° C. | (1) ACD |
PKA | 1.73 ± 0.10 | 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)
Ddwysedd
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Ddwysedd | 1.68 ± 0.1 g/cm3 | Temp: 20 ° C; Gwasg: 760 Torr | (1) ACD |
Cyfaint molar | 217.6 ± 7.0 cm3/mol | Temp: 20 ° C; Gwasg: 760 Torr | (1) ACD |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Lipinski
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Bondiau rotatable yn rhydd | 6 | (1) ACD | |
H Derbynyddion | 11 | (1) ACD | |
H rhoddwyr | 4 | (1) ACD | |
H rhoddwr/derbynnydd swm | 15 | (1) ACD | |
logio | -0.464 ± 0.636 | TEMP: 25 ° C. | (1) ACD |
Pwysau moleciwlaidd | 367.36 |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Strwythur yn gysylltiedig
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Arwynebedd pegynol | 147 A2 | (1) ACD |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Sbectra ar gael
1h nmr
Sbectra ar gael
13c nmr