C17H25N5O7 Guanosine, 2′-O-(2-methoxyethyl)-N-(2-methyl-1-ocsopropyl)-(9CI, A CI)
| Priodweddau Ffisegol Allweddol | Gwerth | Cyflwr |
| Pwysau Moleciwlaidd | 411.41 | - |
| Pwynt Toddi (Arbrofol) | 137-139.2 °C | - |
| Dwysedd (Rhagweld) | 1.60 ± 0.1 g/cm3 | Tymheredd: 20 °C; Gwasg: 760 Torr |
| pKa (Rhagweld) | 8.68±0.20 | Tymheredd Mwyaf Asidig: 25 °C |
Canonaidd gwenu O=C1N=C(NC(=O)C(C)C)NC2=C1N=CN2C3OC(CO)C(O)C3OCCOC
Isomeric SMILES 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
Allwedd InChI
IZOOGJIUOCHAAY-UBEDBUPSSA-N
1 Enw Arall ar y Sylwedd hwn
2′-O-(2-Methoxyethyl)-N-(2-methyl-1-ocsopropyl)gwanosin (ACI)
| Eiddo ar gael |
| Thermol |
Thermol
| Eiddo | Gwerth | Cyflwr | Ffynhonnell |
| Ymdoddbwynt | 137-139.2 °C | (1) CAS | |
(1) Taj, Shabbir Ali S.; Niwcleosidau, Niwcleotidau ac Asidau Niwcleig, (2008), 27(9), 1024-1033, CAplus
Sbectra ar gael
1H NMR
13C NMR
IR
| Eiddo ar gael |
| Biolegol |
| Cemegol |
| Dwysedd |
| Lipinski |
| Strwythur Cysylltiedig |
Biolegol
| Eiddo | Gwerth | Cyflwr | Ffynhonnell |
| Ffactor Bio-ganolbwyntio | 1.0 | pH 1; Tymheredd: 25 °C | (1) ACD |
| Ffactor Bio-ganolbwyntio | 1.0 | pH 2; Tymheredd: 25 °C | (1) ACD |
| Ffactor Bio-ganolbwyntio | 1.0 | pH 3; Tymheredd: 25 °C | (1) ACD |
| Ffactor Bio-ganolbwyntio | 1.0 | pH 4; Tymheredd: 25 °C | (1) ACD |
| Ffactor Bio-ganolbwyntio | 1.0 | pH 5; Tymheredd: 25 °C | (1) ACD |
| Ffactor Bio-ganolbwyntio | 1.0 | pH 6; Tymheredd: 25 °C | (1) ACD |
| Ffactor Bio-ganolbwyntio | 1.0 | pH 7; Tymheredd: 25 °C | (1) ACD |
| Ffactor Bio-ganolbwyntio | 1.0 | pH 8; Tymheredd: 25 °C | (1) ACD |
| Ffactor Bio-ganolbwyntio | 1.0 | pH 9; Tymheredd: 25 °C | (1) ACD |
| Ffactor Bio-ganolbwyntio | 1.0 | pH 10; Tymheredd: 25 °C | (1) ACD |
(1) Wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygiad Cemeg Uwch (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Cemegol
| Eiddo | Gwerth | Cyflwr | Ffynhonnell |
| Koc | 1.0 | pH 1; Tymheredd: 25 °C | (1) ACD |
| Koc | 1.01 | pH 2; Tymheredd: 25 °C | (1) ACD |
| Koc | 5.81 | pH 3; Tymheredd: 25 °C | (1) ACD |
| Koc | 11.4 | pH 4; Tymheredd: 25 °C | (1) ACD |
| Koc | 12.6 | pH 5; Tymheredd: 25 °C | (1) ACD |
| Koc | 12.7 | pH 6; Tymheredd: 25 °C | (1) ACD |
| Koc | 12.5 | pH 7; Tymheredd: 25 °C | (1) ACD |
| Koc | 10.6 | pH 8; Tymheredd: 25 °C | (1) ACD |
| Koc | 4.20 | pH 9; Tymheredd: 25 °C | (1) ACD |
| Koc | 1.0 | pH 10; Tymheredd: 25 °C | (1) ACD |
| logD | -2.44 | pH 1; Tymheredd: 25 °C | (1) ACD |
| logD | -1.60 | pH 2; Tymheredd: 25 °C | (1) ACD |
| logD | -0.84 | pH 3; Tymheredd: 25 °C | (1) ACD |
| logD | -0.55 | pH 4; Tymheredd: 25 °C | (1) ACD |
| logD | -0.50 | pH 5; Tymheredd: 25 °C | (1) ACD |
| logD | -0.50 | pH 6; Tymheredd: 25 °C | (1) ACD |
| logD | -0.51 | pH 7; Tymheredd: 25 °C | (1) ACD |
| logD | -0.58 | pH 8; Tymheredd: 25 °C | (1) ACD |
| logD | -0.98 | pH 9; Tymheredd: 25 °C | (1) ACD |
| logD | -1.76 | pH 10; Tymheredd: 25 °C | (1) ACD |
| logP | -0.497±0.633 | Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Cynhenid Torfol | 0.58 g/L | Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Torfol | 49 g/L | pH 1; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Torfol | 7.0 g/L | pH 2; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Torfol | 1.2 g/L | pH 3; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Torfol | 0.62 g/L | pH 4; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Torfol | 0.58 g/L | pH 5; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Torfol | 0.58 g/L | pH 6; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Torfol | 0.58 g/L | pH 7; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Torfol | 0.70 g/L | pH 8; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Torfol | 1.7 g/L | pH 9; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Torfol | 10 g/L | pH 10; Tymheredd: 25 °C | (1) ACD |
| Eiddo | Gwerth | Cyflwr | Ffynhonnell |
| Hydoddedd Torfol | 0.58 g/L | Dŵr heb ei glustogi pH 5.98; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Cynhenid molar | 1.4 x 10-3 môl/L | Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Molar | 0.12 mol/L | pH 1; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Molar | 0.017 mol/L | pH 2; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Molar | 3.0 x 10-3 mol/L | pH 3; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Molar | 1.5 x 10-3 môl/L | pH 4; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Molar | 1.4 x 10-3 môl/L | pH 5; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Molar | 1.4 x 10-3 môl/L | pH 6; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Molar | 1.4 x 10-3 môl/L | pH 7; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Molar | 1.7 x 10-3 môl/L | pH 8; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Molar | 4.2 x 10-3 môl/L | pH 9; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Molar | 0.025 mol/L | pH 10; Tymheredd: 25 °C | (1) ACD |
| Hydoddedd Molar | 1.4 x 10-3 môl/L | Dŵr heb ei glustogi pH 5.98; Tymheredd: 25 °C | (1) ACD |
| Pwysau Moleciwlaidd | 411.41 | ||
| pKa | 8.68±0.20 | Tymheredd Mwyaf Asidig: 25 °C | (1) ACD |
| pKa | 3.05±0.20 | Tymheredd Mwyaf Sylfaenol: 25 °C | (1) ACD |
(1) Wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygiad Cemeg Uwch (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Dwysedd
| Eiddo | Gwerth | Cyflwr | Ffynhonnell |
| Dwysedd | 1.60 ± 0.1 g/cm3 | Tymheredd: 20 °C; Gwasg: 760 Torr | (1) ACD |
| Cyfrol Molar | 256.2±7.0 cm3/mol | Tymheredd: 20 °C; Gwasg: 760 Torr | (1) ACD |
(1) Wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygiad Cemeg Uwch (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Eiddo | Gwerth | Cyflwr | Ffynhonnell |
| Bondiau Cylchdroadwy | 9 | (1) ACD | |
| H Derbynwyr | 12 | (1) ACD | |
| H Rhoddwyr | 4 | (1) ACD | |
| H Swm Rhoddwr/Derbynnydd | 16 | (1) ACD | |
| logP | -0.497±0.633 | Tymheredd: 25 °C | (1) ACD |
| Pwysau Moleciwlaidd | 411.41 |
(1) Wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygiad Cemeg Uwch (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Strwythur Cysylltiedig
| Eiddo | Gwerth | Cyflwr | Ffynhonnell |
| Arwynebedd Pegynol | 157 A2 | (1) ACD | |
(1) Wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygiad Cemeg Uwch (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Sbectra ar gael
1H NMR
13C NMR
![C21H21N3O6 Thymidin, α – [(1-naphthalenylmethyl)amino]- α -oxo- (ACI)](https://cdn.globalso.com/nvchem/C21H21N3O6-Thymidine-300x300.png)
![C50H58N7O9P Adenosine, N-benzoyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – O-(2-methoxyethyl)-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl ) ffosfforamidit] (ACI)](https://cdn.globalso.com/nvchem/C50H58N7O9P-Adenosine-300x300.png)
![C48H54N7O8P Adenosine, N-benzoyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – O-methyl-, 3′ – [2-cyanoethyl N, N-bis(1-methylethyl)phosphor amidite] (ACI)](https://cdn.globalso.com/nvchem/C48H54N7O8P-300x300.png)
![C41H51N5O8Si Guanosine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-[(1,1- dimethylethyl)dimethylsilyl]-N-(2-methyl-1-ocsopropyl)- (9CI, ACI )](https://cdn.globalso.com/nvchem/C41H51N5O8Si-Guanosine-300x300.jpg)
![C50H60N5O10P Cytidine, N-benzoyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O- (2-methoxyethyl)- 5-methyl-, 3′ – [2-cyanoethyl N,N-bis (1-methylethyl) ffosfforamidit] (ACI)](https://cdn.globalso.com/nvchem/C50H60N5O10P-Cytidine-300x300.png)