C11H16N6O4 Adenosine, 2-amino-2 ′ -O-methyl- (9CI, ACI)

ibicuruzwa

C11H16N6O4 Adenosine, 2-amino-2 ′ -O-methyl- (9CI, ACI)

Amakuru y'ibanze:


Ibicuruzwa birambuye

Ibicuruzwa

Ibisobanuro birambuye

Numero ya CAS

80791-87-3

Ibyingenzi Byumubiri Agaciro Imiterere
Uburemere bwa molekile 296.28 -
Gushonga Ingingo (Ubushakashatsi) 121-122 ° C. Umuti: Methanol
Ingingo yo guteka (Biteganijwe) 733.2 ± 70.0 ° C. Kanda: 760 Torr
Ubucucike (Biteganijwe) 1.98 ± 0.1 g / cm3 Ubushyuhe: 20 ° C;Kanda: 760 Torr
pKa (Byahanuwe) 13.12 ± 0.70 Ubushyuhe bwinshi bwa Acide: 25 ° C.

Andi mazina nibiranga

Urwenya rwa Canonical

OCC1OC (N2C = NC = 3C (= NC (= NC32) N) N) C (OC) C1O

Isomeric SMILES

O (C) [C @ H] 1 [C @ H] (N2C = 3C (N = C2) = C (N) N = C (N) N3) O [C @ H] (CO) [C @ H ] 1O

InChI

InChI = 1S / C11H16N6O4 / c1-20-7-6 (19) 4 (2-18) 21-10 (7) 17-3-14-5-8 (12) 15-11 (13) 16-9 ( 5) 17 / h3-4,6-7,10,18-19H, 2H2,1H3, (H4,12,13,15,16) / t4-, 6-, 7-, 10- / m1 / s1

InChI Urufunguzo

JLWUWXCKSOIFPS-KQYNXXCUSA-N

2 Andi mazina kuriyi ngingo

2-Amino-2 ′ -O-methyladenosine (ACI);2 ′ -O-Methyl-2,6-diaminopurine riboside
Ibyiza birahari
Ubushyuhe

Ubushyuhe

Umutungo Agaciro Imiterere Inkomoko
Ingingo yo gushonga 121-122 ° C. Umuti: Methanol (1) URUBANZA

(1) Koreya, Anilkumar R.;Nucleoside, Nucleotide & Nucleic Acide, (2006), 25 (3), 307-314, CAplus

Ikigereranyo

Spectra irahari
UV na Biboneka

Ibintu Byateganijwe

Ibyiza birahari
Ibinyabuzima
Imiti
Ubucucike
Lipinski
Imiterere ijyanye
Ubushyuhe

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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Agaciro Agaciro Imiterere Inkomoko
Koc 1.0 pH 1;Ubushyuhe: 25 ° C (1) ACD
Koc 1.0 pH 2;Ubushyuhe: 25 ° C (1) ACD
Koc 1.0 pH 3;Ubushyuhe: 25 ° C (1) ACD
Koc 1.21 pH 4;Ubushyuhe: 25 ° C (1) ACD
Koc 6.90 pH 5;Ubushyuhe: 25 ° C (1) ACD
Koc 13.5 pH 6;Ubushyuhe: 25 ° C (1) ACD
Koc 14.9 pH 7;Ubushyuhe: 25 ° C (1) ACD
Koc 15.1 pH 8;Ubushyuhe: 25 ° C (1) ACD
Koc 15.1 pH 9;Ubushyuhe: 25 ° C (1) ACD
Koc 15.1 pH 10;Ubushyuhe: 25 ° C (1) ACD
logD -2,85 pH 1;Ubushyuhe: 25 ° C (1) ACD
logD -2.76 pH 2;Ubushyuhe: 25 ° C (1) ACD
logD -2.31 pH 3;Ubushyuhe: 25 ° C (1) ACD
logD -1.46 pH 4;Ubushyuhe: 25 ° C (1) ACD
logD -0.70 pH 5;Ubushyuhe: 25 ° C (1) ACD
logD -0.41 pH 6;Ubushyuhe: 25 ° C (1) ACD
logD -0.37 pH 7;Ubushyuhe: 25 ° C (1) ACD
logD -0.36 pH 8;Ubushyuhe: 25 ° C (1) ACD
logD -0.36 pH 9;Ubushyuhe: 25 ° C (1) ACD
logD -0.36 pH 10;Ubushyuhe: 25 ° C (1) ACD
logP -0.363 ± 0.611 Ubushyuhe: 25 ° C (1) ACD
Mass Massins Solubility 1.6 g / L Ubushyuhe: 25 ° C (1) ACD
Gukemura ibibazo 504 g / L pH 1;Ubushyuhe: 25 ° C (1) ACD
Gukemura ibibazo 409 g / L pH 2;Ubushyuhe: 25 ° C (1) ACD
Ubushobozi bwa Massage 140 g / L pH 3;Ubushyuhe: 25 ° C (1) ACD
Gukemura ibibazo 20 g / L pH 4;Ubushyuhe: 25 ° C (1) ACD
Gukemura ibibazo 3.6 g / L pH 5;Ubushyuhe: 25 ° C (1) ACD
Ibisubizo bya misa 1.8 g / L pH 6;Ubushyuhe: 25 ° C (1) ACD
Ubushobozi bwa Mass 1.7 g / L pH 7;Ubushyuhe: 25 ° C (1) ACD
Gukemura ibibazo 1.6 g / L pH 8;Ubushyuhe: 25 ° C (1) ACD
Gukemura ibibazo 1.6 g / L pH 9;Ubushyuhe: 25 ° C (1) ACD
Gukemura ibibazo 1.6 g / L pH 10;Ubushyuhe: 25 ° C (1) ACD

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Ubucucike

Umutungo Agaciro Imiterere Inkomoko
Ubucucike 1.98 ± 0.1 g / cm3 Ubushyuhe: 20 ° C;Kanda: 760 Torr (1) ACD
Umubumbe wa Molar 149.3 ± 7.0 cm3 / mol Ubushyuhe: 20 ° C;Kanda: 760 Torr (1) ACD

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Lipinski

Umutungo Agaciro Imiterere Inkomoko
Impapuro zishobora guhinduka 5   (1) ACD
H Abakira 10   (1) ACD
H Abaterankunga 6   (1) ACD
H Abaterankunga / Abemera Sum 16   (1) ACD
logP -0.363 ± 0.611 Ubushyuhe: 25 ° C. (1) ACD
Uburemere bwa molekile 296.28    

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