C30H29FN2O7 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-deoxy-2′- fluoro- (9CI, ACI)
Meatotino Faaletino Autu | Taua | Tulaga |
Molecular Weight | 548.56 | - |
Lisi Lisi (Fa'ata'ita'i) | 118-120 °C | - |
To'atele (Va'ai) | 1.38±0.1g/cm3 | Maalili: 20 °C; Lomitusi: 760 Torr |
pKa (vala'aina) | 9.39±0.10 | Le Tele o le Acid Temp: 25 °C |
O'O'ITA'I 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)C2F
Isomeric SMILES C(OC[C@H]1O[C@H]([C@H](F)[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/C30H29FN2O7/c1-37-22-12-8-20(9-13-22)30(19-6-4-3-5-7-19,21-10-14-23(38- 2)15-11-21)39-18-24-27(35)26(31)28(40-24)33
-17-16-25(34)32-29(33)36/h3-17,24,26-28,35H,18H2,1-2H3,(H,32,34,36)/t24-,26- ,27-,28-/m1/s1
InChI Ki
CSSFZSSZXOCCJB-YULOIDQLSA-N
1 Isi igoa mo lenei mea
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]-2′-deoxy-2′-fluorouridine (ACI)
Meatotino avanoa
Mafanafana
Mafanafana
Meatotino | Taua | Tulaga | Punavai |
Lisi Lisi | 118-120 °C | (1) CAS |
(1) Penjarla, Srishylam; Nucleosides, Nucleotides & Nucleic Acids, (2018), 37(4), 232-247, CAplus
Spectra avanoa
1H NMR
13C NMR
Meatotino avanoa |
Fa'aolaola |
Kemisi |
Malosi |
Lipinski |
Fauga Faatatau |
Fa'aolaola
Meatotino | Taua | Tulaga | Punavai |
Bioconcentration Factor | 3580 | pH 1; Maalili: 25 °C | (1) ACD |
Bioconcentration Factor | 3580 | pH 2; Maalili: 25 °C | (1) ACD |
Bioconcentration Factor | 3580 | pH 3; Maalili: 25 °C | (1) ACD |
Bioconcentration Factor | 3580 | pH 4; Maalili: 25 °C | (1) ACD |
Bioconcentration Factor | 3580 | pH 5; Maalili: 25 °C | (1) ACD |
Bioconcentration Factor | 3580 | pH 6; Maalili: 25 °C | (1) ACD |
Bioconcentration Factor | 3570 | pH 7; Maalili: 25 °C | (1) ACD |
Bioconcentration Factor | 3430 | pH 8; Maalili: 25 °C | (1) ACD |
Bioconcentration Factor | 2500 | pH 9; Maalili: 25 °C | (1) ACD |
Bioconcentration Factor | 689 | pH 10; Maalili: 25 °C | (1) ACD |
(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)
Kemisi
Meatotino | Taua | Tulaga | Punavai |
Koc | 12200 | pH 1; Maalili: 25 °C | (1) ACD |
Koc | 12200 | pH 2; Maalili: 25 °C | (1) ACD |
Koc | 12200 | pH 3; Maalili: 25 °C | (1) ACD |
Koc | 12200 | pH 4; Maalili: 25 °C | (1) ACD |
Koc | 12200 | pH 5; Maalili: 25 °C | (1) ACD |
Koc | 12200 | pH 6; Maalili: 25 °C | (1) ACD |
Koc | 12100 | pH 7; Maalili: 25 °C | (1) ACD |
Koc | 11700 | pH 8; Maalili: 25 °C | (1) ACD |
Koc | 8480 | pH 9; Maalili: 25 °C | (1) ACD |
Koc | 2340 | pH 10; Maalili: 25 °C | (1) ACD |
ogalaauD | 4.98 | pH 1; Maalili: 25 °C | (1) ACD |
ogalaauD | 4.98 | pH 2; Maalili: 25 °C | (1) ACD |
ogalaauD | 4.98 | pH 3; Maalili: 25 °C | (1) ACD |
ogalaauD | 4.98 | pH 4; Maalili: 25 °C | (1) ACD |
ogalaauD | 4.98 | pH 5; Maalili: 25 °C | (1) ACD |
ogalaauD | 4.98 | pH 6; Maalili: 25 °C | (1) ACD |
ogalaauD | 4.98 | pH 7; Maalili: 25 °C | (1) ACD |
ogalaauD | 4.96 | pH 8; Maalili: 25 °C | (1) ACD |
ogalaauD | 4.82 | pH 9; Maalili: 25 °C | (1) ACD |
ogalaauD | 4.26 | pH 10; Maalili: 25 °C | (1) ACD |
logP | 4.979±0.563 | Maalili: 25 °C | (1) ACD |
Mass Intrinsic Solubility | 9.9 x 10-5 g/L | Maalili: 25 °C | (1) ACD |
Mass Solubility | 9.9 x 10-5 g/L | pH 1; Maalili: 25 °C | (1) ACD |
Mass Solubility | 9.9 x 10-5 g/L | pH 2; Maalili: 25 °C | (1) ACD |
Mass Solubility | 9.9 x 10-5 g/L | pH 3; Maalili: 25 °C | (1) ACD |
Mass Solubility | 9.9 x 10-5 g/L | pH 4; Maalili: 25 °C | (1) ACD |
Mass Solubility | 9.9 x 10-5 g/L | pH 5; Maalili: 25 °C | (1) ACD |
Mass Solubility | 9.9 x 10-5 g/L | pH 6; Maalili: 25 °C | (1) ACD |
Mass Solubility | 9.9 x 10-5 g/L | pH 7; Maalili: 25 °C | (1) ACD |
Mass Solubility | 9.9 x 10-5 g/L | pH 8; Maalili: 25 °C | (1) ACD |
Mass Solubility | 1.4 x 10-4 g/L | pH 9; Maalili: 25 °C | (1) ACD |
Mass Solubility | 5.0 x 10-4 g/L | pH 10; Maalili: 25 °C | (1) ACD |
Meatotino | Taua | Tulaga | Punavai |
Mass Solubility | 9.9 x 10-5 g/L | Suavai e le fa'afefe pH 7.00; Maalili: 25 °C | (1) ACD |
Molar Intrinsic Solubility | 1.8 x 10-7 mol/L | Maalili: 25 °C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol/L | pH 1; Maalili: 25 °C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol/L | pH 2; Maalili: 25 °C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol/L | pH 3; Maalili: 25 °C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol/L | pH 4; Maalili: 25 °C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol/L | pH 5; Maalili: 25 °C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol/L | pH 6; Maalili: 25 °C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol/L | pH 7; Maalili: 25 °C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol/L | pH 8; Maalili: 25 °C | (1) ACD |
Molar Solubility | 2.5 x 10-7 mol/L | pH 9; Maalili: 25 °C | (1) ACD |
Molar Solubility | 9.2 x 10-7 mol/L | pH 10; Maalili: 25 °C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol/L | Suavai e le fa'afefe pH 7.00; Maalili: 25 °C | (1) ACD |
Molecular Weight | 548.56 | ||
pKa | 9.39±0.10 | Le Tele o le Acid Temp: 25 °C | (1) ACD |
(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)
Malosi
Meatotino | Taua | Tulaga | Punavai |
Malosi | 1.38±0.1g/cm3 | Maalili: 20 °C; Lomitusi: 760 Torr | (1) ACD |
Molar Volume | 395.8±5.0 cm3/mol | Maalili: 20 °C; Lomitusi: 760 Torr | (1) ACD |
(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)
Lipinski
Meatotino | Taua | Tulaga | Punavai |
Noanoaga e mafai ona fesuia'i saoloto | 10 | (1) ACD | |
H Tagata talia | 9 | (1) ACD | |
H Donors | 2 | (1) ACD | |
H Fa'ameaalofa/Tagata Talia | 11 | (1) ACD | |
logP | 4.979±0.563 | Maalili: 25 °C | (1) ACD |
Molecular Weight | 548.56 |
(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)
Fauga Faatatau
Meatotino | Taua | Tulaga | Punavai |
Polar Surface Area | 107 A2 | (1) ACD |
(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)
Spectra avanoa
1H NMR
13C NMR