C31H32N2O8 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyl- (9C I, ACI)
Nga Ahuatanga Tinana Matua | Uara | Tikanga |
Taumaha rāpoi | 560.60 | - |
Kiato (I Matapaetia) | 1.35±0.1 g/cm3 | Te Mahana: 20 °C; Perehi: 760 Torr |
pKa (I matapaetia) | 9.39±0.10 | Te Mahana Waiwawa Nui: 25 °C |
MATE O=C1C=CN(C(=O)N1)C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C= C5)C(O)C2OC
NGĀ ATA ISOMERC C(OC[C@H]1O[C@H]([C@H](OC)[C@@H]1O)N2C(=O)NC(=O)C=C2)(C3= CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChI
InChI=1S/C31H32N2O8/c1-37-23-13-9-21(10-14-23)31(20-7-5-4-6-8 -20,22-11-15-24(38-2)16-12-22)40-19-25-27(35)28(39-3)29(41-25)
33-18-17-26(34)32-30(33)36/h4-18,25,27-29,35H,19H2,1-3H3,(H,32,34,36)/t25-,27 -,28-,29-/m1/s1
Kī InChI
MFDHAVFJDSRPKC-YXINZVNLSA-N
2 Ētahi atu Ingoa mō tēnei Matū
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyluridine (ACI); 5′-O-(4,4′-Dimethoxytrityl)-2′-O-methyluridine
Kei te waatea te Spectra
1H NMR
Mass
Nga rawa e waatea ana |
Koiora |
Te matū |
Kiato |
Lipinski |
Hanganga e Pa ana |
Koiora
Taonga | Uara | Tikanga | Puna |
Tauwehe Bioconcentration | 1240 | pH 1; Te Mamahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1240 | pH 2; Te Mamahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1240 | pH 3; Te Mamahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1240 | pH 4; Te Mamahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1240 | pH 5; Te Mamahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1240 | pH 6; Te Mamahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1230 | pH 7; Te Mamahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 1190 | pH 8; Te Mamahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 861 | pH 9; Te Mamahana: 25 °C | (1) ACD |
Tauwehe Bioconcentration | 238 | pH 10; Te Mamahana: 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 | 5690 | pH 1; Te Mamahana: 25 °C | (1) ACD |
Koc | 5690 | pH 2; Te Mamahana: 25 °C | (1) ACD |
Koc | 5690 | pH 3; Te Mamahana: 25 °C | (1) ACD |
Koc | 5690 | pH 4; Te Mamahana: 25 °C | (1) ACD |
Koc | 5690 | pH 5; Te Mamahana: 25 °C | (1) ACD |
Koc | 5690 | pH 6; Te Mamahana: 25 °C | (1) ACD |
Koc | 5670 | pH 7; Te Mamahana: 25 °C | (1) ACD |
Koc | 5450 | pH 8; Te Mamahana: 25 °C | (1) ACD |
Taonga | Uara | Tikanga | Puna |
Koc | 3960 | pH 9; Te Mamahana: 25 °C | (1) ACD |
Koc | 1100 | pH 10; Te Mamahana: 25 °C | (1) ACD |
rangitakiD | 4.37 | pH 1; Te Mamahana: 25 °C | (1) ACD |
rangitakiD | 4.37 | pH 2; Te Mamahana: 25 °C | (1) ACD |
rangitakiD | 4.37 | pH 3; Te Mamahana: 25 °C | (1) ACD |
rangitakiD | 4.37 | pH 4; Te Mamahana: 25 °C | (1) ACD |
rangitakiD | 4.37 | pH 5; Te Mamahana: 25 °C | (1) ACD |
rangitakiD | 4.37 | pH 6; Te Mamahana: 25 °C | (1) ACD |
rangitakiD | 4.37 | pH 7; Te Mamahana: 25 °C | (1) ACD |
rangitakiD | 4.35 | pH 8; Te Mamahana: 25 °C | (1) ACD |
rangitakiD | 4.21 | pH 9; Te Mamahana: 25 °C | (1) ACD |
rangitakiD | 3.66 | pH 10; Te Mamahana: 25 °C | (1) ACD |
rangitakiP | 4.372±0.582 | Te Mamahana: 25 °C | (1) ACD |
Te Wairewa o roto | 3.7 x 10-4 g/L | Te Mamahana: 25 °C | (1) ACD |
Wairewa Papatipu | 3.7 x 10-4 g/L | pH 1; Te Mamahana: 25 °C | (1) ACD |
Wairewa Papatipu | 3.7 x 10-4 g/L | pH 2; Te Mamahana: 25 °C | (1) ACD |
Wairewa Papatipu | 3.7 x 10-4 g/L | pH 3; Te Mamahana: 25 °C | (1) ACD |
Wairewa Papatipu | 3.7 x 10-4 g/L | pH 4; Te Mamahana: 25 °C | (1) ACD |
Wairewa Papatipu | 3.7 x 10-4 g/L | pH 5; Te Mamahana: 25 °C | (1) ACD |
Wairewa Papatipu | 3.7 x 10-4 g/L | pH 6; Te Mamahana: 25 °C | (1) ACD |
Wairewa Papatipu | 3.7 x 10-4 g/L | pH 7; Te Mamahana: 25 °C | (1) ACD |
Wairewa Papatipu | 3.8 x 10-4 g/L | pH 8; Te Mamahana: 25 °C | (1) ACD |
Wairewa Papatipu | 5.3 x 10-4 g/L | pH 9; Te Mamahana: 25 °C | (1) ACD |
Wairewa Papatipu | 1.9 x 10-3 g/L | pH 10; Te Mamahana: 25 °C | (1) ACD |
Wairewa Papatipu | 3.7 x 10-4 g/L | Te Wai Kore Kore Te pH 6.99; Te Mamahana: 25 °C | (1) ACD |
Molar Intrinsic Solubility | 6.6 x 10-7 mol/L | Te Mamahana: 25 °C | (1) ACD |
Molar Solubility | 6.6 x 10-7 mol/L | pH 1; Te Mamahana: 25 °C | (1) ACD |
Molar Solubility | 6.6 x 10-7 mol/L | pH 2; Te Mamahana: 25 °C | (1) ACD |
Molar Solubility | 6.6 x 10-7 mol/L | pH 3; Te Mamahana: 25 °C | (1) ACD |
Molar Solubility | 6.6 x 10-7 mol/L | pH 4; Te Mamahana: 25 °C | (1) ACD |
Molar Solubility | 6.6 x 10-7 mol/L | pH 5; Te Mamahana: 25 °C | (1) ACD |
Molar Solubility | 6.6 x 10-7 mol/L | pH 6; Te Mamahana: 25 °C | (1) ACD |
Taonga | Uara | Tikanga | Puna |
Molar Solubility | 6.6 x 10-7 mol/L | pH 7; Te Mamahana: 25 °C | (1) ACD |
Molar Solubility | 6.8 x 10-7 mol/L | pH 8; Te Mamahana: 25 °C | (1) ACD |
Molar Solubility | 9.4 x 10-7 mol/L | pH 9; Te Mamahana: 25 °C | (1) ACD |
Molar Solubility | 3.4 x 10-6 mol/L | pH 10; Te Mamahana: 25 °C | (1) ACD |
Molar Solubility | 6.6 x 10-7 mol/L | Te Wai Kore Kore Te pH 6.99; Te Mamahana: 25 °C | (1) ACD |
Taumaha rāpoi | 560.60 | ||
pKa | 9.39±0.10 | Te Mahana Waiwawa Nui: 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 | 1.35±0.1 g/cm3 | Te Mahana: 20 °C; Perehi: 760 Torr | (1) ACD |
Rōrahi Moara | 412.9±5.0 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 | 11 | (1) ACD | |
H Nga Kaiwhiwhi | 10 | (1) ACD | |
H Nga Kaituku | 2 | (1) ACD | |
H Tapeke Kaituku/Kaiwhiwhi | 12 | (1) ACD | |
rangitakiP | 4.372±0.582 | Te Mamahana: 25 °C | (1) ACD |
Taumaha rāpoi | 560.60 |
(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 | 116 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