C15H21N5O6 Guanosine, 2'-O-Methyl-N- (2-methyl-1-oxopropyl)-(9CI, ACI)

nghynnyrch

C15H21N5O6 Guanosine, 2'-O-Methyl-N- (2-methyl-1-oxopropyl)-(9CI, ACI)

Gwybodaeth Sylfaenol:


Manylion y Cynnyrch

Tagiau cynnyrch

Priodweddau Ffisegol

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.

Enwau a dynodwyr eraill

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

Eiddo a ragwelir

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 a ragwelir

Sbectra ar gael
1h nmr

Sbectra ar gael
13c nmr


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