C30H29FN2O7 Uridine, 5′-O-

Amakuru y'ibanze:

Ohereza imeri kuri twe

Ibicuruzwa birambuye

Ibicuruzwa

Imiterere yumubiri

Ibyingenzi Byumubiri	Agaciro	Imiterere
Uburemere bwa molekile	548.56	-
Ingingo yo gushonga (Ubushakashatsi)	118-120 ° C.	-
Ubucucike (Biteganijwe)	1.38 ± 0.1 g / cm3	Ubushyuhe: 20 ° C; Kanda: 760 Torr
pKa (Byahanuwe)	9.39 ± 0.10	Ubushyuhe bwinshi bwa Acide: 25 ° C.

Andi mazina nibiranga

Urwenya rwa Canonical 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) C2F
SMILES Isomeric C (OC [C @ H] 1O [C @ H] ([C @ H] (F) [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 / C30H29FN2O7 / c1-37-22-12-8-20 (9-13-22) 30 (19-6-4-3-5-7-19,21-10-14-23 (38- 2) 15-11-21) 39-18-24-27 (35) 26 (31) 28 (40-24) 33
-17-16-25 (34) 32-29 (33) 36 / h3-17,24,26-28,35H, 18H2,1-2H3, (H, 32,34,36) / t24-, 26- , 27-, 28- / m1 / s1
InChI Urufunguzo
CSSFZSSZXOCCJB-YULOIDQLSA-N
1 Irindi zina kuriyi ngingo
5′-O- [Bis (4-mikorerexyphenyl) fenylmethyl] -2′-deoxy-2′-fluorouridine (ACI)

Ibyiza Byubushakashatsi

Ibyiza birahari
Ubushyuhe

Ubushyuhe

Umutungo	Agaciro	Imiterere	Inkomoko
Ingingo yo gushonga	118-120 ° C.	(1) URUBANZA

(1) Penjarla, Srishylam; Nucleoside, Nucleotide & Acide Nucleic, (2018), 37 (4), 232-247, CAplus

Ikigereranyo

Spectra irahari
1H NMR
13C NMR

Ibintu Byateganijwe

Ibyiza birahari

Ibinyabuzima

Imiti

Ubucucike

Lipinski

Imiterere ijyanye

Ibinyabuzima

Umutungo	Agaciro	Imiterere	Inkomoko
Ikintu cya Bioconcentration	3580	pH 1; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	3580	pH 2; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	3580	pH 3; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	3580	pH 4; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	3580	pH 5; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	3580	pH 6; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	3570	pH 7; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	3430	pH 8; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	2500	pH 9; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	689	pH 10; Ubushyuhe: 25 ° C.	(1) ACD

Imiti

Umutungo	Agaciro	Imiterere	Inkomoko
Koc	12200	pH 1; Ubushyuhe: 25 ° C.	(1) ACD
Koc	12200	pH 2; Ubushyuhe: 25 ° C.	(1) ACD
Koc	12200	pH 3; Ubushyuhe: 25 ° C.	(1) ACD
Koc	12200	pH 4; Ubushyuhe: 25 ° C.	(1) ACD
Koc	12200	pH 5; Ubushyuhe: 25 ° C.	(1) ACD
Koc	12200	pH 6; Ubushyuhe: 25 ° C.	(1) ACD
Koc	12100	pH 7; Ubushyuhe: 25 ° C.	(1) ACD
Koc	11700	pH 8; Ubushyuhe: 25 ° C.	(1) ACD
Koc	8480	pH 9; Ubushyuhe: 25 ° C.	(1) ACD
Koc	2340	pH 10; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.98	pH 1; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.98	pH 2; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.98	pH 3; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.98	pH 4; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.98	pH 5; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.98	pH 6; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.98	pH 7; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.96	pH 8; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.82	pH 9; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.26	pH 10; Ubushyuhe: 25 ° C.	(1) ACD
logP	4.979 ± 0.563	Ubushyuhe: 25 ° C.	(1) ACD
Mass Massins Solubility	9.9 x 10-5 g / L.	Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	9.9 x 10-5 g / L.	pH 1; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	9.9 x 10-5 g / L.	pH 2; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	9.9 x 10-5 g / L.	pH 3; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	9.9 x 10-5 g / L.	pH 4; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	9.9 x 10-5 g / L.	pH 5; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	9.9 x 10-5 g / L.	pH 6; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	9.9 x 10-5 g / L.	pH 7; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	9.9 x 10-5 g / L.	pH 8; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	1.4 x 10-4 g / L.	pH 9; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	5.0 x 10-4 g / L.	pH 10; Ubushyuhe: 25 ° C.	(1) ACD

Umutungo	Agaciro	Imiterere	Inkomoko
Gukemura ibibazo	9.9 x 10-5 g / L.	Amazi adafite ingufu pH 7.00; Ubushyuhe: 25 ° C.	(1) ACD
Molar Intrinsic Solubility	1.8 x 10-7 mol / L.	Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	1.8 x 10-7 mol / L.	pH 1; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	1.8 x 10-7 mol / L.	pH 2; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	1.8 x 10-7 mol / L.	pH 3; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	1.8 x 10-7 mol / L.	pH 4; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	1.8 x 10-7 mol / L.	pH 5; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	1.8 x 10-7 mol / L.	pH 6; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	1.8 x 10-7 mol / L.	pH 7; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	1.8 x 10-7 mol / L.	pH 8; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	2.5 x 10-7 mol / L.	pH 9; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	9.2 x 10-7 mol / L.	pH 10; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	1.8 x 10-7 mol / L.	Amazi adafite ingufu pH 7.00; Ubushyuhe: 25 ° C.	(1) ACD
Uburemere bwa molekile	548.56
pKa	9.39 ± 0.10	Ubushyuhe bwinshi bwa Acide: 25 ° C.	(1) ACD

Ubucucike

Umutungo	Agaciro	Imiterere	Inkomoko
Ubucucike	1.38 ± 0.1 g / cm3	Ubushyuhe: 20 ° C; Kanda: 760 Torr	(1) ACD
Umubumbe wa Molar	395.8 ± 5.0 cm3 / mol	Ubushyuhe: 20 ° C; Kanda: 760 Torr	(1) ACD

Lipinski

Umutungo	Agaciro	Imiterere	Inkomoko
Impapuro zishobora guhinduka	10		(1) ACD
H Abakira	9		(1) ACD
H Abaterankunga	2		(1) ACD
H Abaterankunga / Abemera Sum	11		(1) ACD
logP	4.979 ± 0.563	Ubushyuhe: 25 ° C.	(1) ACD
Uburemere bwa molekile	548.56