![C39h37n5o7 Adenosine, N-Benzoyl-5'-o- "bis (4-methoxyphenyl) penylmethyl] -2'- o-methyl- (9ci, aci)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
C39h37n5o7 Adenosine, N-Benzoyl-5'-o- "bis (4-methoxyphenyl) penylmethyl] -2'- o-methyl- (9ci, aci)
| Cov Khoom Tseem Ceeb | Tus nqi | Yam tseem ceeb |
| Molecular hnyav | 687.74 | - |
| Ntom ntom (kwv yees) | 1.32 ± 0.1 g / cm3 | Temp: 20 ° C; XOVXWM: 760 Torr |
| PKA (kwv yees) | 7.87 ± 0.43 | Feem ntau acidic temp: 25 ° C |
Canonical smiles o = NC1 = NC = NC2 = cnc = cc = cc = cc = cc = cc = cc = cc = c.c) c = 7c = cc = cc)
Isomeric luag
C (OC [C @O H] 1o [C @ H] (CC = CC = CC = CC = CC = CC = CC = CC = C7
Tus hauv onei
Inchi = 1s / c39h37n5o7 / c1-47-29-14-29-12-8-5 (48-17-22-33 (45) 34 (49-3) 38 (51- 31) 44-24-42-32-32-32-32-32-36 (40-26 (326) 25-1000, (h, 40,41,46) / t31-, 33-,
34-, 38- / M1 / S1
Inchi tus yuam sij
Sarhdaqozzzcc-cjegosrcsa-n
1 Lwm lub npe rau cov khoom siv no
N-benzoyl-5'-o- [me (4-methoxyphenyl) penylmethyl] -2'-o-methyladenosine (ACI)
Spectra muaj
1h nmr
13C NMR
Qho hnyav
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 | 47800 | PH 1; Temp: 25 ° C | (1) ACD |
| Bioconclivration qhov tseem ceeb | 1.63 X 105 | PHA 2; Temp: 25 ° C | (1) ACD |
| Bioconclivration qhov tseem ceeb | 2.16 x 105 | PH 3; Temp: 25 ° C | (1) ACD |
| Bioconclivration qhov tseem ceeb | 2.23 x 105 | PH 4; Temp: 25 ° C | (1) ACD |
| Bioconclivration qhov tseem ceeb | 2.23 x 105 | PH 5; Temp: 25 ° C | (1) ACD |
| Bioconclivration qhov tseem ceeb | 2.18 x 105 | p.c; Temp: 25 ° C | (1) ACD |
| Bioconclivration qhov tseem ceeb | 1.79 x 105 | pH 7; Temp: 25 ° C | (1) ACD |
| Bioconclivration qhov tseem ceeb | 64900 | PH 8; Temp: 25 ° C | (1) ACD |
| Bioconclivration qhov tseem ceeb | 10600 | PH 9; Temp: 25 ° C | (1) ACD |
| Bioconclivration qhov tseem ceeb | 3110 | 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 | 5000 | PH 1; Temp: 25 ° C | (1) ACD |
| Txhim hoom | 1.71 x 105 | PHA 2; Temp: 25 ° C | (1) ACD |
| Txhim hoom | 2.26 x 105 | PH 3; Temp: 25 ° C | (1) ACD |
| Txhim hoom | 2.34 x 105 | PH 4; Temp: 25 ° C | (1) ACD |
| Txhim hoom | 2.34 x 105 | PH 5; Temp: 25 ° C | (1) ACD |
| Txhim hoom | 2.29 x 105 | p.c; Temp: 25 ° C | (1) ACD |
| Txhim hoom | 1.88 x 105 | pH 7; Temp: 25 ° C | (1) ACD |
| Ntiag tug | Tus nqi | Yam tseem ceeb | Lub hauv paus |
| Txhim hoom | 68000 | PH 8; Temp: 25 ° C | (1) ACD |
| Txhim hoom | 11200 | PH 9; Temp: 25 ° C | (1) ACD |
| Txhim hoom | 3260 | pH 10; Temp: 25 ° C | (1) ACD |
| logd | 6.67 | PH 1; Temp: 25 ° C | (1) ACD |
| logd | 7.21 | PHA 2; Temp: 25 ° C | (1) ACD |
| logd | 7.33 | PH 3; Temp: 25 ° C | (1) ACD |
| logd | 7.34 | PH 4; Temp: 25 ° C | (1) ACD |
| logd | 7.34 | PH 5; Temp: 25 ° C | (1) ACD |
| logd | 7.33 | p.c; Temp: 25 ° C | (1) ACD |
| logd | 7.25 | pH 7; Temp: 25 ° C | (1) ACD |
| logd | 6.80 | PH 8; Temp: 25 ° C | (1) ACD |
| logd | 6.02 | PH 9; Temp: 25 ° C | (1) ACD |
| logd | 5.49 | pH 10; Temp: 25 ° C | (1) ACD |
| lub cim | 7.344 ± 0.723 | Temp: 25 ° C | (1) ACD |
| Kev ua yeeb yam loj solubility solubility | 2.7 x 10-6 g / l | Temp: 25 ° C | (1) ACD |
| Loj solubility | 1.2 x 10-5 g / l | PH 1; Temp: 25 ° C | (1) ACD |
| Loj solubility | 3.7 x 10-6 g / l | PHA 2; Temp: 25 ° C | (1) ACD |
| Loj solubility | 2.8 x 10-6 g / l | PH 3; Temp: 25 ° C | (1) ACD |
| Loj solubility | 2.8 x 10-6 g / l | PH 4; Temp: 25 ° C | (1) ACD |
| Loj solubility | 2.8 x 10-6 g / l | PH 5; Temp: 25 ° C | (1) ACD |
| Loj solubility | 2.8 x 10-6 g / l | p.c; Temp: 25 ° C | (1) ACD |
| Loj solubility | 3.4 x 10-6 g / l | pH 7; Temp: 25 ° C | (1) ACD |
| Loj solubility | 9.6 x 10-6 g / l | PH 8; Temp: 25 ° C | (1) ACD |
| Loj solubility | 5.7 x 10-5 g / l | PH 9; Temp: 25 ° C | (1) ACD |
| Loj solubility | 1.9 x 10-4 g / l | pH 10; Temp: 25 ° C | (1) ACD |
| Loj solubility | 3.4 x 10-6 g / l | Unbuffered dej pH 7.00; Temp: 25 ° C | (1) ACD |
| Molar intrinsic solubility | 3.9 x 10-9 mol / l | Temp: 25 ° C | (1) ACD |
| Raug solubility | 1.8 x 10-8 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
| Raug solubility | 5.4 x 10-9 mol / l | PHA 2; Temp: 25 ° C | (1) ACD |
| Raug solubility | 4.1 x 10-9 mol / l | PH 3; Temp: 25 ° C | (1) ACD |
| Raug solubility | 4.0 X 10-9 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
| Raug solubility | 4.0 X 10-9 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
| Ntiag tug | Tus nqi | Yam tseem ceeb | Lub hauv paus |
| Raug solubility | 4.0 X 10-9 mol / l | p.c; Temp: 25 ° C | (1) ACD |
| Raug solubility | 4.9 x 10-9 mol / l | pH 7; Temp: 25 ° C | (1) ACD |
| Raug solubility | 1.4 x 10-8 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
| Raug solubility | 8.3 x 10-8 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
| Raug solubility | 2.8 x 10-7 mol / l | pH 10; Temp: 25 ° C | (1) ACD |
| Raug solubility | 4.9 x 10-9 mol / l | Unbuffered dej pH 7.00; Temp: 25 ° C | (1) ACD |
| Molecular hnyav | 687.74 | ||
| 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 | 1.32 ± 0.1 g / cm3 | Temp: 20 ° C; XOVXWM: 760 Torr | (1) ACD |
| Cov pob zeb ntim | 518.5 ± 7.0 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 | 12 | (1) ACD | |
| H neeg txais | 12 | (1) ACD | |
| H pub dawb | 2 | (1) ACD | |
| H pub dawb / txais nyiaj | 14 | (1) ACD | |
| lub cim | 7.344 ± 0.723 | Temp: 25 ° C | (1) ACD |
| Molecular hnyav | 687.74 |
(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 | 139 A2 | (1) ACD | |
(1) Xam siv cov kev txhim kho me me (ACD / Labs) software v11.02 (© 1994-2023 ACD / Labs)
Spectra muaj
1h nmr
Spectra muaj
13C NMR
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