![C31H32N2O8 Uridina, 5′-O-[bis(4-metossifenil)fenilmetil]-2′-O-metil- (9C I, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C31H32N2O8 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyl- (9C I, ACI) Stampa Dehru](https://cdn.globalso.com/nvchem/C31H32N2O8-Uridine.jpg)
C31H32N2O8 Uridina, 5′-O-[bis(4-metossifenil)fenilmetil]-2′-O-metil- (9C I, ACI)
| Proprjetajiet Fiżiċi Ewlenin | Valur | Kundizzjoni |
| Piż Molekulari | 560.60 | - |
| Densità (Imbassar) | 1.35±0.1 g/cm3 | Temp: 20 °C; Press: 760 Torr |
| pKa (Imbassar) | 9.39±0.10 | L-aktar Temp Aċidiku: 25 °C |
Canonical SMILES 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
Tbissim iżomeriċi 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
InChI Key
MFDHAVFJDSRPKC-YXINZVNLSA-N
2 Ismijiet Oħra għal din is-Sustanza
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyluridine (ACI); 5′-O-(4,4′-Dimethoxytrityl)-2′-O-methyluridine
Spettri disponibbli
1H NMR
Quddiesa
| Proprjetajiet disponibbli |
| Bijoloġiċi |
| Kimika |
| Densità |
| Lipinski |
| Struttura Relatati |
Bijoloġiċi
| Proprjetà | Valur | Kundizzjoni | Sors |
| Fattur tal-Bijokonċentrazzjoni | 1240 | pH 1; Temp: 25 °C | (1) ACD |
| Fattur tal-Bijokonċentrazzjoni | 1240 | pH 2; Temp: 25 °C | (1) ACD |
| Fattur tal-Bijokonċentrazzjoni | 1240 | pH 3; Temp: 25 °C | (1) ACD |
| Fattur tal-Bijokonċentrazzjoni | 1240 | pH 4; Temp: 25 °C | (1) ACD |
| Fattur tal-Bijokonċentrazzjoni | 1240 | pH 5; Temp: 25 °C | (1) ACD |
| Fattur tal-Bijokonċentrazzjoni | 1240 | pH 6; Temp: 25 °C | (1) ACD |
| Fattur tal-Bijokonċentrazzjoni | 1230 | pH 7; Temp: 25 °C | (1) ACD |
| Fattur tal-Bijokonċentrazzjoni | 1190 | pH 8; Temp: 25 °C | (1) ACD |
| Fattur tal-Bijokonċentrazzjoni | 861 | pH 9; Temp: 25 °C | (1) ACD |
| Fattur tal-Bijokonċentrazzjoni | 238 | pH 10; Temp: 25 °C | (1) ACD |
(1) Ikkalkulat bl-użu ta' Software għall-Iżvilupp tal-Kimika Avvanzata (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Kimika
| Proprjetà | Valur | Kundizzjoni | Sors |
| Koc | 5690 | pH 1; Temp: 25 °C | (1) ACD |
| Koc | 5690 | pH 2; Temp: 25 °C | (1) ACD |
| Koc | 5690 | pH 3; Temp: 25 °C | (1) ACD |
| Koc | 5690 | pH 4; Temp: 25 °C | (1) ACD |
| Koc | 5690 | pH 5; Temp: 25 °C | (1) ACD |
| Koc | 5690 | pH 6; Temp: 25 °C | (1) ACD |
| Koc | 5670 | pH 7; Temp: 25 °C | (1) ACD |
| Koc | 5450 | pH 8; Temp: 25 °C | (1) ACD |
| Proprjetà | Valur | Kundizzjoni | Sors |
| Koc | 3960 | pH 9; Temp: 25 °C | (1) ACD |
| Koc | 1100 | pH 10; Temp: 25 °C | (1) ACD |
| logD | 4.37 | pH 1; Temp: 25 °C | (1) ACD |
| logD | 4.37 | pH 2; Temp: 25 °C | (1) ACD |
| logD | 4.37 | pH 3; Temp: 25 °C | (1) ACD |
| logD | 4.37 | pH 4; Temp: 25 °C | (1) ACD |
| logD | 4.37 | pH 5; Temp: 25 °C | (1) ACD |
| logD | 4.37 | pH 6; Temp: 25 °C | (1) ACD |
| logD | 4.37 | pH 7; Temp: 25 °C | (1) ACD |
| logD | 4.35 | pH 8; Temp: 25 °C | (1) ACD |
| logD | 4.21 | pH 9; Temp: 25 °C | (1) ACD |
| logD | 3.66 | pH 10; Temp: 25 °C | (1) ACD |
| logP | 4.372±0.582 | Temp: 25 °C | (1) ACD |
| Solubilità Intrinsika tal-Massa | 3.7 x 10-4 g/L | Temp: 25 °C | (1) ACD |
| Solubilità tal-Massa | 3.7 x 10-4 g/L | pH 1; Temp: 25 °C | (1) ACD |
| Solubilità tal-Massa | 3.7 x 10-4 g/L | pH 2; Temp: 25 °C | (1) ACD |
| Solubilità tal-Massa | 3.7 x 10-4 g/L | pH 3; Temp: 25 °C | (1) ACD |
| Solubilità tal-Massa | 3.7 x 10-4 g/L | pH 4; Temp: 25 °C | (1) ACD |
| Solubilità tal-Massa | 3.7 x 10-4 g/L | pH 5; Temp: 25 °C | (1) ACD |
| Solubilità tal-Massa | 3.7 x 10-4 g/L | pH 6; Temp: 25 °C | (1) ACD |
| Solubilità tal-Massa | 3.7 x 10-4 g/L | pH 7; Temp: 25 °C | (1) ACD |
| Solubilità tal-Massa | 3.8 x 10-4 g/L | pH 8; Temp: 25 °C | (1) ACD |
| Solubilità tal-Massa | 5.3 x 10-4 g/L | pH 9; Temp: 25 °C | (1) ACD |
| Solubilità tal-Massa | 1.9 x 10-3 g/L | pH 10; Temp: 25 °C | (1) ACD |
| Solubilità tal-Massa | 3.7 x 10-4 g/L | Ilma mhux buffered pH 6.99; Temp: 25 °C | (1) ACD |
| Solubilità Intrinsika Molari | 6.6 x 10-7 mol/L | Temp: 25 °C | (1) ACD |
| Solubilità Molari | 6.6 x 10-7 mol/L | pH 1; Temp: 25 °C | (1) ACD |
| Solubilità Molari | 6.6 x 10-7 mol/L | pH 2; Temp: 25 °C | (1) ACD |
| Solubilità Molari | 6.6 x 10-7 mol/L | pH 3; Temp: 25 °C | (1) ACD |
| Solubilità Molari | 6.6 x 10-7 mol/L | pH 4; Temp: 25 °C | (1) ACD |
| Solubilità Molari | 6.6 x 10-7 mol/L | pH 5; Temp: 25 °C | (1) ACD |
| Solubilità Molari | 6.6 x 10-7 mol/L | pH 6; Temp: 25 °C | (1) ACD |
| Proprjetà | Valur | Kundizzjoni | Sors |
| Solubilità Molari | 6.6 x 10-7 mol/L | pH 7; Temp: 25 °C | (1) ACD |
| Solubilità Molari | 6.8 x 10-7 mol/L | pH 8; Temp: 25 °C | (1) ACD |
| Solubilità Molari | 9.4 x 10-7 mol/L | pH 9; Temp: 25 °C | (1) ACD |
| Solubilità Molari | 3.4 x 10-6 mol/L | pH 10; Temp: 25 °C | (1) ACD |
| Solubilità Molari | 6.6 x 10-7 mol/L | Ilma mhux buffered pH 6.99; Temp: 25 °C | (1) ACD |
| Piż Molekulari | 560.60 | ||
| pKa | 9.39±0.10 | L-aktar Temp Aċidiku: 25 °C | (1) ACD |
(1) Ikkalkulat bl-użu ta' Software għall-Iżvilupp tal-Kimika Avvanzata (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Densità
| Proprjetà | Valur | Kundizzjoni | Sors |
| Densità | 1.35±0.1 g/cm3 | Temp: 20 °C; Press: 760 Torr | (1) ACD |
| Volum Molari | 412.9±5.0 cm3/mol | Temp: 20 °C; Press: 760 Torr | (1) ACD |
(1) Ikkalkulat bl-użu ta' Software għall-Iżvilupp tal-Kimika Avvanzata (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Proprjetà | Valur | Kundizzjoni | Sors |
| Bonds li Jduru liberament | 11 | (1) ACD | |
| H Aċċettaturi | 10 | (1) ACD | |
| H Donaturi | 2 | (1) ACD | |
| H Somma tad-Donatur/Aċċettatur | 12 | (1) ACD | |
| logP | 4.372±0.582 | Temp: 25 °C | (1) ACD |
| Piż Molekulari | 560.60 |
(1) Ikkalkulat bl-użu ta' Software għall-Iżvilupp tal-Kimika Avvanzata (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Struttura Relatati
| Proprjetà | Valur | Kundizzjoni | Sors |
| Żona tal-wiċċ Polari | 116 A2 | (1) ACD | |
(1) Ikkalkulat bl-użu ta' Software għall-Iżvilupp tal-Kimika Avvanzata (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Spettri disponibbli
1H NMR
13C NMR
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![C9H10N2O5 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-6-one, 2,3,3a,9a-tetrah ydro-3-hydroxy-2-(hydroxymethyl)- , (2R,3 R,3aS,9aR)- (9CI, ACI)](https://cdn.globalso.com/nvchem/C9H10N2O5-6H-Furo-300x300.png)
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![C33H39N5O6 L-Ornithinamide, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-valyl-N5- (aminocarbonyl)-N-[4-(hydroxymethyl)phenyl]- (9CI, ACI)](https://cdn.globalso.com/nvchem/C33H39N5O6-L-Ornithinamide-300x300.jpg)
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