C17H25N5O7 Guanosine, 2′-O-(2-methoxyethyl)-N-(2-methyl-1-oxopropyl)- (9CI, A CI)
Sifa Muhimu za Kimwili | Thamani | Hali |
Uzito wa Masi | 411.41 | - |
Kiwango Myeyuko (Majaribio) | 137-139.2 °C | - |
Msongamano (Uliotabiriwa) | 1.60±0.1 g/cm3 | Joto: 20 ° C; Bonyeza: 760 Torr |
pKa (Iliyotabiriwa) | 8.68±0.20 | Halijoto ya Asidi Zaidi: 25 °C |
TABASAMU za Kisheria O=C1N=C(NC(=O)C(C)C)NC2=C1N=CN2C3OC(CO)C(O)C3OCCOC
TABASAMU ZA Isomeric O=C1C2=C(N(C=N2)[C@H]3[C@H](OCCOC)[C@H](O)[C@@H](CO)O3)NC(NC (C(C)C)=O)=N1
InChI
InChI=1S/C17H25N5O7/c1-8(2)14(25)20-17-19-13-10(15(26)21-17)18 -7-22(13)16-12(28-5-4-27-3)11(24)9(6-23)29-16/h7-9,11-12,16,23- 24H,4-6H2,1-3H3,(H2,19,20,21,25,26)/t9-,11-,12-,16-/m1/s1
Ufunguo wa InChi
IZOOGJIUOCHAAY-UBEDBUPSSA-N
1 Jina Lingine la Dawa hii
2′-O-(2-Methoxyethyl)-N-(2-methyl-1-oxopropyl)guanosine (ACI)
Mali zinazopatikana |
Joto |
Joto
Mali | Thamani | Hali | Chanzo |
Kiwango Myeyuko | 137-139.2 °C | (1) CAS |
(1) Taj, Shabbir Ali S.; Nucleosides, Nucleotides & Nucleic Acids, (2008), 27(9), 1024-1033, CAplus
Spectra inapatikana
1H NMR
13C NMR
IR
Mali zinazopatikana |
Kibiolojia |
Kemikali |
Msongamano |
Lipinski |
Kuhusiana na Muundo |
Kibiolojia
Mali | Thamani | Hali | Chanzo |
Kipengele cha Mkusanyiko wa Kibiolojia | 1.0 | pH 1; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 1.0 | pH 2; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 1.0 | pH 3; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 1.0 | pH 4; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 1.0 | pH 5; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 1.0 | pH 6; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 1.0 | pH 7; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 1.0 | pH 8; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 1.0 | pH 9; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 1.0 | pH 10; Joto: 25 °C | (1) ACD |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Kemikali
Mali | Thamani | Hali | Chanzo |
Koc | 1.0 | pH 1; Joto: 25 °C | (1) ACD |
Koc | 1.01 | pH 2; Joto: 25 °C | (1) ACD |
Koc | 5.81 | pH 3; Joto: 25 °C | (1) ACD |
Koc | 11.4 | pH 4; Joto: 25 °C | (1) ACD |
Koc | 12.6 | pH 5; Joto: 25 °C | (1) ACD |
Koc | 12.7 | pH 6; Joto: 25 °C | (1) ACD |
Koc | 12.5 | pH 7; Joto: 25 °C | (1) ACD |
Koc | 10.6 | pH 8; Joto: 25 °C | (1) ACD |
Koc | 4.20 | pH 9; Joto: 25 °C | (1) ACD |
Koc | 1.0 | pH 10; Joto: 25 °C | (1) ACD |
logD | -2.44 | pH 1; Joto: 25 °C | (1) ACD |
logD | -1.60 | pH 2; Joto: 25 °C | (1) ACD |
logD | -0.84 | pH 3; Joto: 25 °C | (1) ACD |
logD | -0.55 | pH 4; Joto: 25 °C | (1) ACD |
logD | -0.50 | pH 5; Joto: 25 °C | (1) ACD |
logD | -0.50 | pH 6; Joto: 25 °C | (1) ACD |
logD | -0.51 | pH 7; Joto: 25 °C | (1) ACD |
logD | -0.58 | pH 8; Joto: 25 °C | (1) ACD |
logD | -0.98 | pH 9; Joto: 25 °C | (1) ACD |
logD | -1.76 | pH 10; Joto: 25 °C | (1) ACD |
logP | -0.497±0.633 | Joto: 25 °C | (1) ACD |
Umumunyifu wa Ndani wa Misa | 0.58 g/L | Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 49 g/L | pH 1; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 7.0 g/L | pH 2; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 1.2 g/L | pH 3; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 0.62 g/L | pH 4; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 0.58 g/L | pH 5; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 0.58 g/L | pH 6; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 0.58 g/L | pH 7; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 0.70 g/L | pH 8; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 1.7 g/L | pH 9; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 10 g/L | pH 10; Joto: 25 °C | (1) ACD |
Mali | Thamani | Hali | Chanzo |
Umumunyifu wa Misa | 0.58 g/L | Maji yasio na buffered pH 5.98; Joto: 25 °C | (1) ACD |
Umumunyifu wa Ndani wa Molar | 1.4 x 10-3 mol/L | Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 0.12 mol/L | pH 1; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 0.017 mol/L | pH 2; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 3.0 x 10-3 mol/L | pH 3; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 1.5 x 10-3 mol/L | pH 4; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 1.4 x 10-3 mol/L | pH 5; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 1.4 x 10-3 mol/L | pH 6; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 1.4 x 10-3 mol/L | pH 7; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 1.7 x 10-3 mol/L | pH 8; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 4.2 x 10-3 mol/L | pH 9; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 0.025 mol/L | pH 10; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 1.4 x 10-3 mol/L | Maji yasio na buffered pH 5.98; Joto: 25 °C | (1) ACD |
Uzito wa Masi | 411.41 | ||
pKa | 8.68±0.20 | Halijoto ya Asidi Zaidi: 25 °C | (1) ACD |
pKa | 3.05±0.20 | Joto la Msingi Zaidi: 25 °C | (1) ACD |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Msongamano
Mali | Thamani | Hali | Chanzo |
Msongamano | 1.60±0.1 g/cm3 | Joto: 20 ° C; Bonyeza: 760 Torr | (1) ACD |
Kiasi cha Molar | 256.2±7.0 cm3/mol | Joto: 20 ° C; Bonyeza: 760 Torr | (1) ACD |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Lipinski
Mali | Thamani | Hali | Chanzo |
Vifungo vinavyoweza kuzungushwa kwa Uhuru | 9 | (1) ACD | |
H Wapokeaji | 12 | (1) ACD | |
H Wafadhili | 4 | (1) ACD | |
H Jumla ya Mfadhili/Mpokeaji | 16 | (1) ACD | |
logP | -0.497±0.633 | Joto: 25 °C | (1) ACD |
Uzito wa Masi | 411.41 |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Kuhusiana na Muundo
Mali | Thamani | Hali | Chanzo |
Eneo la Uso wa Polar | 157 A2 | (1) ACD |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Spectra inapatikana
1H NMR
13C NMR