C17H25N5O7 Guanosine, 2′-O-(2-methoxyethyl)-N-(2-methyl-1-oxopropyl)- (9CI, A CI)

hua

C17H25N5O7 Guanosine, 2′-O-(2-methoxyethyl)-N-(2-methyl-1-oxopropyl)- (9CI, A CI)

Mōhiohio Taketake:


Taipitopito Hua

Tohu Hua

Ngā āhuatanga ā-tinana

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

Ētahi atu Ingoa me nga Kaitohu

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)

Ngā Āhuatanga Whakamātautau

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

Spectra Whakamatau

Kei te waatea te Spectra
1H NMR
13C NMR
IR

Nga Taonga Matapae

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)

Tohua Matapae

Kei te waatea te Spectra
1H NMR
13C NMR


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