C17H25N5O7 Guanosine, 2′-O-(2-methoxyethyl)-N-(2-methyl-1-oxopropyl)- (9CI, A CI)
Nga Ahuatanga Tinana Matua | Uara | Tikanga |
Taumaha rāpoi | 411.41 | - |
Ira Whakarewa (Whakamatau) | 137-139.2 °C | - |
Kiato (I Matapaetia) | 1.60±0.1 g/cm3 | Te Mahana: 20 °C; Perehi: 760 Torr |
pKa (I Matapaetia) | 8.68±0.20 | Te Mahana Waiwawa Nui: 25 °C |
NGĀ ATA KANAKA O=C1N=C(NC(=O)C(C)C)NC2=C1N=CN2C3OC(CO)C(O)C3OCCOC
NGĀ ATA ISOMERO O=C1C2=C(N(C=N2)[C@H]3[C@H](OCCOC)[C@H](O)[C@@H](CO)O3)NC(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
Kī InChI
IZOOGJIUOCHAAY-UBEDBUPSSA-N
1 Ētahi atu Ingoa mō tēnei matū
2′-O-(2-Methoxyethyl)-N-(2-methyl-1-oxopropyl)guanosine (ACI)
Nga rawa e waatea ana |
Ngawha |
Ngawha
Taonga | Uara | Tikanga | Puna |
Te Whakarewarewa | 137-139.2 °C | (1) CAS |
(1) Taj, Shabbir Ali S.; Nucleosides, Nucleotides & Nucleic acids, (2008), 27(9), 1024-1033, CAplus
Kei te waatea te Spectra
1H NMR
13C NMR
IR
Nga rawa e waatea ana |
Koiora |
Te matū |
Kiato |
Lipinski |
Hanganga e Pa ana |
Koiora
Taonga | Uara | Tikanga | Puna |
Tauwehe Bioconcentration | 1.0 | pH 1; Te Mahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1.0 | pH 2; Te Mahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1.0 | pH 3; Te Mahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1.0 | pH 4; Te Mahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1.0 | pH 5; Te Mahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1.0 | pH 6; Te Mahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1.0 | pH 7; Te Mahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1.0 | pH 8; Te Mahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1.0 | pH 9; Te Mahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1.0 | pH 10; Te Mahana: 25 °C | (1) ACD |
(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)
Te matū
Taonga | Uara | Tikanga | Puna |
Koc | 1.0 | pH 1; Te Mahana: 25 °C | (1) ACD |
Koc | 1.01 | pH 2; Te Mahana: 25 °C | (1) ACD |
Koc | 5.81 | pH 3; Te Mahana: 25 °C | (1) ACD |
Koc | 11.4 | pH 4; Te Mahana: 25 °C | (1) ACD |
Koc | 12.6 | pH 5; Te Mahana: 25 °C | (1) ACD |
Koc | 12.7 | pH 6; Te Mahana: 25 °C | (1) ACD |
Koc | 12.5 | pH 7; Te Mahana: 25 °C | (1) ACD |
Koc | 10.6 | pH 8; Te Mahana: 25 °C | (1) ACD |
Koc | 4.20 | pH 9; Te Mahana: 25 °C | (1) ACD |
Koc | 1.0 | pH 10; Te Mahana: 25 °C | (1) ACD |
rangitakiD | -2.44 | pH 1; Te Mahana: 25 °C | (1) ACD |
rangitakiD | -1.60 | pH 2; Te Mahana: 25 °C | (1) ACD |
rangitakiD | -0.84 | pH 3; Te Mahana: 25 °C | (1) ACD |
rangitakiD | -0.55 | pH 4; Te Mahana: 25 °C | (1) ACD |
rangitakiD | -0.50 | pH 5; Te Mahana: 25 °C | (1) ACD |
rangitakiD | -0.50 | pH 6; Te Mahana: 25 °C | (1) ACD |
rangitakiD | -0.51 | pH 7; Te Mahana: 25 °C | (1) ACD |
rangitakiD | -0.58 | pH 8; Te Mahana: 25 °C | (1) ACD |
rangitakiD | -0.98 | pH 9; Te Mahana: 25 °C | (1) ACD |
rangitakiD | -1.76 | pH 10; Te Mahana: 25 °C | (1) ACD |
rangitakiP | -0.497±0.633 | Te Mahana: 25 °C | (1) ACD |
Te Wairewa o roto | 0.58 g/L | Te Mahana: 25 °C | (1) ACD |
Wairewa Papatipu | 49 g/L | pH 1; Te Mahana: 25 °C | (1) ACD |
Wairewa Papatipu | 7.0 g/L | pH 2; Te Mahana: 25 °C | (1) ACD |
Wairewa Papatipu | 1.2 g/L | pH 3; Te Mahana: 25 °C | (1) ACD |
Wairewa Papatipu | 0.62 g/L | pH 4; Te Mahana: 25 °C | (1) ACD |
Wairewa Papatipu | 0.58 g/L | pH 5; Te Mahana: 25 °C | (1) ACD |
Wairewa Papatipu | 0.58 g/L | pH 6; Te Mahana: 25 °C | (1) ACD |
Wairewa Papatipu | 0.58 g/L | pH 7; Te Mahana: 25 °C | (1) ACD |
Wairewa Papatipu | 0.70 g/L | pH 8; Te Mahana: 25 °C | (1) ACD |
Wairewa Papatipu | 1.7 g/L | pH 9; Te Mahana: 25 °C | (1) ACD |
Wairewa Papatipu | 10 g/L | pH 10; Te Mahana: 25 °C | (1) ACD |
Taonga | Uara | Tikanga | Puna |
Wairewa Papatipu | 0.58 g/L | Te Wai Whakakore pH 5.98; Te Mahana: 25 °C | (1) ACD |
Molar Intrinsic Solubility | 1.4 x 10-3 mol/L | Te Mahana: 25 °C | (1) ACD |
Molar Solubility | 0.12 mol/L | pH 1; Te Mahana: 25 °C | (1) ACD |
Molar Solubility | 0.017 mol/L | pH 2; Te Mahana: 25 °C | (1) ACD |
Molar Solubility | 3.0 x 10-3 mol/L | pH 3; Te Mahana: 25 °C | (1) ACD |
Molar Solubility | 1.5 x 10-3 mol/L | pH 4; Te Mahana: 25 °C | (1) ACD |
Molar Solubility | 1.4 x 10-3 mol/L | pH 5; Te Mahana: 25 °C | (1) ACD |
Molar Solubility | 1.4 x 10-3 mol/L | pH 6; Te Mahana: 25 °C | (1) ACD |
Molar Solubility | 1.4 x 10-3 mol/L | pH 7; Te Mahana: 25 °C | (1) ACD |
Molar Solubility | 1.7 x 10-3 mol/L | pH 8; Te Mahana: 25 °C | (1) ACD |
Molar Solubility | 4.2 x 10-3 mol/L | pH 9; Te Mahana: 25 °C | (1) ACD |
Molar Solubility | 0.025 mol/L | pH 10; Te Mahana: 25 °C | (1) ACD |
Molar Solubility | 1.4 x 10-3 mol/L | Te Wai Whakakore pH 5.98; Te Mahana: 25 °C | (1) ACD |
Taumaha rāpoi | 411.41 | ||
pKa | 8.68±0.20 | Te Mahana Waiwawa Nui: 25 °C | (1) ACD |
pKa | 3.05±0.20 | Te Mahana Matua: 25 °C | (1) ACD |
(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)
Kiato
Taonga | Uara | Tikanga | Puna |
Kiato | 1.60±0.1 g/cm3 | Te Mahana: 20 °C; Perehi: 760 Torr | (1) ACD |
Rōrahi Moara | 256.2±7.0 cm3/mol | Te Mahana: 20 °C; Perehi: 760 Torr | (1) ACD |
(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)
Lipinski
Taonga | Uara | Tikanga | Puna |
Nga here e taea te huri noa | 9 | (1) ACD | |
H Nga Kaiwhiwhi | 12 | (1) ACD | |
H Nga Kaituku | 4 | (1) ACD | |
H Tapeke Kaituku/Kaiwhiwhi | 16 | (1) ACD | |
rangitakiP | -0.497±0.633 | Te Mahana: 25 °C | (1) ACD |
Taumaha rāpoi | 411.41 |
(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)
Hanganga e Pa ana
Taonga | Uara | Tikanga | Puna |
Rohe Mata Polar | 157 A2 | (1) ACD |
(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)
Kei te waatea te Spectra
1H NMR
13C NMR