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

ibicuruzwa

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

Amakuru y'ibanze:


Ibicuruzwa birambuye

Ibicuruzwa

Imiterere yumubiri

Ibyingenzi Byumubiri Agaciro Imiterere
Uburemere bwa molekile 411.41 -
Ingingo yo gushonga (Ubushakashatsi) 137-139.2 ° C. -
Ubucucike (Biteganijwe) 1.60 ± 0.1 g / cm3 Ubushyuhe: 20 ° C; Kanda: 760 Torr
pKa (Byahanuwe) 8.68 ± 0.20 Ubushyuhe bwinshi bwa Acide: 25 ° C.

Andi mazina nibiranga

Urwenya rwa Canonical O = C1N = C (NC (= O) C (C) C) NC2 = C1N = CN2C3OC (CO) C (O) C3OCCOC
SMILES Isomeric O = C1C2 = C (N (C = N2) [C @ H] 3 [C @ H] (OCCOC) [C @ H] (O) [C @@ H] (CO) O3) 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
InChI Urufunguzo
IZOOGJIUOCHAAY-UBEDBUPSSA-N
1 Irindi zina kuriyi ngingo
2′-O- (2-Methoxyethyl) -N- (2-methyl-1-oxopropyl) guanosine (ACI)

Ibyiza Byubushakashatsi

Ibyiza birahari
Ubushyuhe

Ubushyuhe

Umutungo Agaciro Imiterere Inkomoko
Ingingo yo gushonga 137-139.2 ° C. (1) URUBANZA

(1) Taj, Shabbir Ali S.; Nucleoside, Nucleotide & Acide Nucleic, (2008), 27 (9), 1024-1033, CAplus

Ikigereranyo

Spectra irahari
1H NMR
13C NMR
IR

Ibintu Byateganijwe

Ibyiza birahari
Ibinyabuzima
Imiti
Ubucucike
Lipinski
Imiterere ijyanye

Ibinyabuzima

Umutungo Agaciro Imiterere Inkomoko
Ikintu cya Bioconcentration 1.0 pH 1; Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 2; Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 3; Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 4; Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 5; Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 6; Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 7; Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 8; Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 9; Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 10; Ubushyuhe: 25 ° C. (1) ACD

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Imiti

Umutungo Agaciro Imiterere Inkomoko
Koc 1.0 pH 1; Ubushyuhe: 25 ° C. (1) ACD
Koc 1.01 pH 2; Ubushyuhe: 25 ° C. (1) ACD
Koc 5.81 pH 3; Ubushyuhe: 25 ° C. (1) ACD
Koc 11.4 pH 4; Ubushyuhe: 25 ° C. (1) ACD
Koc 12.6 pH 5; Ubushyuhe: 25 ° C. (1) ACD
Koc 12.7 pH 6; Ubushyuhe: 25 ° C. (1) ACD
Koc 12.5 pH 7; Ubushyuhe: 25 ° C. (1) ACD
Koc 10.6 pH 8; Ubushyuhe: 25 ° C. (1) ACD
Koc 4.20 pH 9; Ubushyuhe: 25 ° C. (1) ACD
Koc 1.0 pH 10; Ubushyuhe: 25 ° C. (1) ACD
logD -2.44 pH 1; Ubushyuhe: 25 ° C. (1) ACD
logD -1.60 pH 2; Ubushyuhe: 25 ° C. (1) ACD
logD -0.84 pH 3; Ubushyuhe: 25 ° C. (1) ACD
logD -0.55 pH 4; Ubushyuhe: 25 ° C. (1) ACD
logD -0.50 pH 5; Ubushyuhe: 25 ° C. (1) ACD
logD -0.50 pH 6; Ubushyuhe: 25 ° C. (1) ACD
logD -0.51 pH 7; Ubushyuhe: 25 ° C. (1) ACD
logD -0.58 pH 8; Ubushyuhe: 25 ° C. (1) ACD
logD -0.98 pH 9; Ubushyuhe: 25 ° C. (1) ACD
logD -1.76 pH 10; Ubushyuhe: 25 ° C. (1) ACD
logP -0.497 ± 0.633 Ubushyuhe: 25 ° C. (1) ACD
Mass Massins Solubility 0.58 g / L. Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 49 g / L. pH 1; Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 7.0 g / L. pH 2; Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 1.2 g / L. pH 3; Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 0,62 g / L. pH 4; Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 0.58 g / L. pH 5; Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 0.58 g / L. pH 6; Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 0.58 g / L. pH 7; Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 0,70 g / L. pH 8; Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 1.7 g / L. pH 9; Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 10 g / L. pH 10; Ubushyuhe: 25 ° C. (1) ACD

 

Umutungo Agaciro Imiterere Inkomoko
Gukemura ibibazo 0.58 g / L. Amazi adafite ingufu pH 5.98; Ubushyuhe: 25 ° C. (1) ACD
Molar Intrinsic Solubility 1.4 x 10-3 mol / L. Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0,12 mol / L. pH 1; Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0.017 mol / L. pH 2; Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 3.0 x 10-3 mol / L. pH 3; Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 1.5 x 10-3 mol / L. pH 4; Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 1.4 x 10-3 mol / L. pH 5; Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 1.4 x 10-3 mol / L. pH 6; Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 1.4 x 10-3 mol / L. pH 7; Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 1.7 x 10-3 mol / L. pH 8; Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 4.2 x 10-3 mol / L. pH 9; Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0.025 mol / L. pH 10; Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 1.4 x 10-3 mol / L. Amazi adafite ingufu pH 5.98; Ubushyuhe: 25 ° C. (1) ACD
Uburemere bwa molekile 411.41    
pKa 8.68 ± 0.20 Ubushyuhe bwinshi bwa Acide: 25 ° C. (1) ACD
pKa 3.05 ± 0.20 Ubushyuhe bwibanze: 25 ° C. (1) ACD

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Ubucucike

Umutungo Agaciro Imiterere Inkomoko
Ubucucike 1.60 ± 0.1 g / cm3 Ubushyuhe: 20 ° C; Kanda: 760 Torr (1) ACD
Umubumbe wa Molar 256.2 ± 7.0 cm3 / mol Ubushyuhe: 20 ° C; Kanda: 760 Torr (1) ACD

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Lipinski

Umutungo Agaciro Imiterere Inkomoko
Impapuro zishobora guhinduka 9   (1) ACD
H Abakira 12   (1) ACD
H Abaterankunga 4   (1) ACD
H Abaterankunga / Abemera Sum 16   (1) ACD
logP -0.497 ± 0.633 Ubushyuhe: 25 ° C. (1) ACD
Uburemere bwa molekile 411.41    

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Imiterere ijyanye

Umutungo Agaciro

Imiterere

Inkomoko
Ubuso bwa polarike 157 A2 (1) ACD

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Ibiteganijwe

Spectra irahari
1H NMR
13C NMR


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