C17h17n5So5 Adenosine, N-Benzoyl- (7ci, 9Ci, ACI) H333, H303, H302

khoom

C17h17n5So5 Adenosine, N-Benzoyl- (7ci, 9Ci, ACI) H333, H303, H302

Cov Lus Qhia Yooj Yim:


Khoom Qhia Qhia

Khoom Ntawv

Cov Khoom Siv Lub Cev

Cov Khoom Tseem Ceeb Tus nqi Yam tseem ceeb
Molecular hnyav 371.35 -
Melting taw tes (sim) 152 ° C -
Ntom ntom (kwv yees) 1.70 ± 0.1 g / cm3 Temp: 20 ° C; XOVXWM: 760 Torr
PKA (kwv yees) 7.87 ± 0.43 Feem ntau acidic temp: 25 ° C

Lwm lub npe thiab cov cim

Canonical smiles o = NC1 = NC = NC2 = NC2 = CN2 = CN2C3OC (CE) C3O) C = 4C = CC = CC4
Isomeric smiles o [b @ h] 1 [k € (n2c = cc = cc = cc = cc = cc = cc = c.c)
Tus hauv onei
Inchi = 1s / c17h17n5o5 / c23-6-10-12 (18) 22) 21-16 (18) 9-4-4-5 / h1-5 /7-8,12-13,17, 23-25h, 6h2, (H, 18,19,11,26) / T10-, 12-, 13- / / M1 / ​​S1
Inchi tus yuam sij
Nzdwtkfdauooda-cnemsgdsa-n
3 lwm lub npe rau cov khoom siv no
Benzamide, N- (9-β-d-ribofuranosyl-9h-purin-6-yl) - (8ci); N-benzoyladenosine (ACI); N6-Benzoyladenosine

Cov Khoom Siv Kev Ntxim Sim

Cov khoom muaj
Thermal

Thermal

Ntiag tug

Tus nqi

Yam tseem ceeb Lub hauv paus
Melting point

152 ° C

(1) IC

(1) gopalakrishnan, vidhya; Cov Txheej Txheem Kev Tshawb Fawb - Indian Academemy, Tshuaj Sciences, (1989), 101 (51 (401-13, CAPPU

Sim spectra

Spectra muaj
1h nmr
13C NMR
Hetero Nmr
IR

Kwv yees cov thaj chaw

Cov khoom muaj
Kev muaj txuj Ci
Tshuaj
Ceev
Ncauj lus di ncauj
Cov qauv muaj feem xyuam

Kev muaj txuj Ci

Ntiag tug Tus nqi Yam tseem ceeb Lub hauv paus
Bioconclivration qhov tseem ceeb 1.0 PH 1; Temp: 25 ° C (1) ACD
Bioconclivration qhov tseem ceeb 1.83 PHA 2; Temp: 25 ° C (1) ACD
Bioconclivration qhov tseem ceeb 2.56 PH 3; Temp: 25 ° C (1) ACD
Bioconclivration qhov tseem ceeb 2.67 PH 4; Temp: 25 ° C (1) ACD
Bioconclivration qhov tseem ceeb 2.68 PH 5; Temp: 25 ° C (1) ACD
Bioconclivration qhov tseem ceeb 2.65 p.c; Temp: 25 ° C (1) ACD
Bioconclivration qhov tseem ceeb 2.37 pH 7; Temp: 25 ° C (1) ACD
Bioconclivration qhov tseem ceeb 1.16 PH 8; Temp: 25 ° C (1) ACD
Bioconclivration qhov tseem ceeb 1.0 PH 9; Temp: 25 ° C (1) ACD
Bioconclivration qhov tseem ceeb 1.0 pH 10; Temp: 25 ° C (1) ACD

(1) Xam siv cov kev txhim kho me me (ACD / Labs) software v11.02 (© 1994-2023 ACD / Labs)

Tshuaj

Ntiag tug Tus nqi Yam tseem ceeb Lub hauv paus
Txhim hoom 12.6 PH 1; Temp: 25 ° C (1) ACD
Txhim hoom 48.2 PHA 2; Temp: 25 ° C (1) ACD
Txhim hoom 67.3 PH 3; Temp: 25 ° C (1) ACD
Txhim hoom 70.1 PH 4; Temp: 25 ° C (1) ACD
Txhim hoom 70.3 PH 5; Temp: 25 ° C (1) ACD
Txhim hoom 69.5 p.c; Temp: 25 ° C (1) ACD
Txhim hoom 62.2 pH 7; Temp: 25 ° C (1) ACD
Txhim hoom 30.5 PH 8; Temp: 25 ° C (1) ACD
Txhim hoom 5.54 PH 9; Temp: 25 ° C (1) ACD
Txhim hoom 1.22 pH 10; Temp: 25 ° C (1) ACD
logd 0.12 PH 1; Temp: 25 ° C (1) ACD
logd 0.70 PHA 2; Temp: 25 ° C (1) ACD
logd 0.85 PH 3; Temp: 25 ° C (1) ACD
logd 0.86 PH 4; Temp: 25 ° C (1) ACD
logd 0.87 PH 5; Temp: 25 ° C (1) ACD
logd 0.86 p.c; Temp: 25 ° C (1) ACD
logd 0.81 pH 7; Temp: 25 ° C (1) ACD
logd 0.50 PH 8; Temp: 25 ° C (1) ACD
logd -0.24 PH 9; Temp: 25 ° C (1) ACD
logd -0.89 pH 10; Temp: 25 ° C (1) ACD
lub cim 0.868 ± 0.577 Temp: 25 ° C (1) ACD
Kev ua yeeb yam loj solubility solubility 0.037 g / l Temp: 25 ° C (1) ACD
Loj solubility 0.22 g / l PH 1; Temp: 25 ° C (1) ACD
Loj solubility 0.056 g / l PHA 2; Temp: 25 ° C (1) ACD
Loj solubility 0.041 g / l PH 3; Temp: 25 ° C (1) ACD
Loj solubility 0.041 g / l PH 4; Temp: 25 ° C (1) ACD
Loj solubility 0.037 g / l PH 5; Temp: 25 ° C (1) ACD
Loj solubility 0.041 g / l p.c; Temp: 25 ° C (1) ACD
Loj solubility 0.045 g / l pH 7; Temp: 25 ° C (1) ACD
Loj solubility 0.089 g / l PH 8; Temp: 25 ° C (1) ACD
Loj solubility 0.48 g / l PH 9; Temp: 25 ° C (1) ACD
Loj solubility 2.2 g / l pH 10; Temp: 25 ° C (1) ACD

 

Ntiag tug Tus nqi Yam tseem ceeb Lub hauv paus
Loj solubility 0.041 g / l Unbuffered dej p 5.93; Temp: 25 ° C (1) ACD
Molar intrinsic solubility 1.0 x 10-4 mol / l Temp: 25 ° C (1) ACD
Raug solubility 5.8 x 10-4 mol / l PH 1; Temp: 25 ° C (1) ACD
Raug solubility 1.5 x 10-4 mol / l PHA 2; Temp: 25 ° C (1) ACD
Raug solubility 1.1 x 10-4 mol / l PH 3; Temp: 25 ° C (1) ACD
Raug solubility 1.1 x 10-4 mol / l PH 4; Temp: 25 ° C (1) ACD
Raug solubility 1.0 x 10-4 mol / l PH 5; Temp: 25 ° C (1) ACD
Raug solubility 1.1 x 10-4 mol / l p.c; Temp: 25 ° C (1) ACD
Raug solubility 1.2 x 10-4 mol / l pH 7; Temp: 25 ° C (1) ACD
Raug solubility 2.4 x 10-4 mol / l PH 8; Temp: 25 ° C (1) ACD
Raug solubility 1.3 x 10-3 mol / l PH 9; Temp: 25 ° C (1) ACD
Raug solubility 6.0 x 10-3 mol / l pH 10; Temp: 25 ° C (1) ACD
Raug solubility 1.1 x 10-4 mol / l Unbuffered dej p 5.93; Temp: 25 ° C (1) ACD
Molecular hnyav 371.35    
pa kua muag 7.87 ± 0.43 Feem ntau acidic temp: 25 ° C (1) ACD
pa kua muag 1.39 ± 0.10 Feem ntau cov sam luam: 25 ° C (1) ACD

(1) Xam siv cov kev txhim kho me me (ACD / Labs) software v11.02 (© 1994-2023 ACD / Labs)

Ceev

Ntiag tug Tus nqi Yam tseem ceeb Lub hauv paus
Ceev 1.70 ± 0.1 g / cm3 Temp: 20 ° C; XOVXWM: 760 Torr (1) ACD
Cov pob zeb ntim 217.3 ± 4.0 CM3 / Mol Temp: 20 ° C; XOVXWM: 760 Torr (1) ACD

(1) Xam siv cov kev txhim kho me me (ACD / Labs) software v11.02 (© 1994-2023 ACD / Labs)

Ncauj lus di ncauj

Ntiag tug Tus nqi Yam tseem ceeb Lub hauv paus
Dawb doatable bonds 6   (1) ACD
H neeg txais 10   (1) ACD
H pub dawb 4   (1) ACD
H pub dawb / txais nyiaj 14   (1) ACD
lub cim 0.868 ± 0.577 Temp: 25 ° C (1) ACD
Molecular hnyav 371.35    

(1) Xam siv cov kev txhim kho me me (ACD / Labs) software v11.02 (© 1994-2023 ACD / Labs)

Cov qauv muaj feem xyuam

Ntiag tug Tus nqi

Yam tseem ceeb

Lub hauv paus
Polar Thaj Chaw Thaj Chaw 143 A2 (1) ACD

(1) Xam siv cov kev txhim kho me me (ACD / Labs) software v11.02 (© 1994-2023 ACD / Labs)

Kwv yees spectra

Spectra muaj
1h nmr
13C NMR

GHS cov lus txaus ntshai

Txoj cai Cov lus sib haum Lub hauv paus
H333 Tej zaum yuav tsim txom yog nqus tau Kws muaj txuj ci yeej
H303 Tej zaum yuav tsim kev puas tsuaj yog tias nqos Kws muaj txuj ci yeej
H302 Muaj teeb meem yog nqos Koom Haum Kev Koom Tes Hauv Tebchaws Europe (cha) Kev Qhia Tawm - Tshaj Tawm Cov Lus Qhia thiab Cov Ntawv Cim Cov Ntawv Sau Npe - Cov Ntawv Qhia Cov Ntawv Sau Npe - Tshaj Tawm Cov Ntawv Qhia Kev Kawm Ntawv - Cov Ntawv Qhia Loj

Cov Lus Qhia Txog Cov Ntaub Ntawv

Cov Ntawv Kev Cai: ncav cuag, tcsi

Cov ntaub ntawv ua lag luam tsis pub lwm tus paub: Pej xeem

Kev tswj cov lus qhuab qhia
Adenosine, n-benzoyl- Ncav cuag, tcsi

-

N- {9 - [(2R, 4S, 5RSDREd-5- Dihydroxy-5- YL] oxolan-2-YL] -9h-purin-6-yl} benzamide Ncav cuag

-

N6-Benzoyladenosine Ncav cuag

-

Cov ntsiab lus los ntawm lub teb chaws / thoob ntiaj teb & Lwm cov npe tebchaws / thaj av muaj

European Union Cov Ntsiab Lus

Cov Lus Nug Cov Ntaub Ntawv Nyob Rau Npe Sau Npe

https://echa.europa.eu/substance-_formformation/-/substanceinfo/100.132.658

Cov Ntawv Teev Npe Tus Kheej EC Tsis yog.: 610-251-3

Taiwan cov ntsiab lus

Cov lus nug cov xwm txheej ntawm TCSi TCSi TCSI tsoomfwv Ga


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