C39H37N5ENOSE, N-Benzoyl-5'-Be- O- O (4-Methoxypheshyyyyl) Phensylmethyyl] -2'- O-methyl- (9ci, ACI, ACI)
Njirimara nke anụ ahụ | Baa uru | Onodu |
Molular ibu | 687.74 | - |
Nnọọ (buru amụma) | 1.32 ± 0.1 g / cm3 | Temp: 20 Celsius C; Pịa: 760 Torr |
pka (buru amụma) | 7.87 ± 0.43 | Ọtụtụ elekere acid: 25 Celsius C |
Sminical smonical o = c (NC1 = NC2 = CN2C3C (OC) c = CC4) C = CC = CC = CC7
Inomeric Smimụmụ ọnụ ọchị
C (OC [C @) 1O [c @) (N = CC))
ICHi
InChI=1S/C39H37N5O7/c1-47-29-18-14-27(15-19-29)39(26-12-8-5-9-13-26,28-16-20-30(48-2)21-17-28)50-22-31-33(45)34(49-3)38(51- 31) 44-2422222222-35 (40-23-41-36 (32) 44-37 (36), 2h3,43,43,43,, 33-,, 33-,
34-, 38- / M1 / S1
Igodo inchi
Srohdaqznkzcc-cjegosrcsa-n
1 aha ndị ọzọ maka ihe a
N-benzoyl-5'-o- o- o- O (4-methoxyponneryyl) Phenylmethyl] -2'-o-methyladenosine (ACI)
Ihe nkiri dị
1h nmr
13C nmr
Uka
Njirimara dị
Bayoloji
Kemikal
Keuju
Lipinski
Ọdịdị metụtara
Bayoloji
Aku | Baa uru | Onodu | Nsiputa |
Biononerd Proctor | 47800 | ph 1; Temp: 25 ° C | (1) ACD |
Biononerd Proctor | 1.63 x 105 | ph 2; Temp: 25 ° C | (1) ACD |
Biononerd Proctor | 2.16 x 105 | ph 3; Temp: 25 ° C | (1) ACD |
Biononerd Proctor | 2.23 x 105 | ph 4; Temp: 25 ° C | (1) ACD |
Biononerd Proctor | 2.23 x 105 | ph 5; Temp: 25 ° C | (1) ACD |
Biononerd Proctor | 2.18 x 105 | ph 6; Temp: 25 ° C | (1) ACD |
Biononerd Proctor | 1.79 x 105 | ph 7; Temp: 25 ° C | (1) ACD |
Biononerd Proctor | 64900 | ph 8; Temp: 25 ° C | (1) ACD |
Biononerd Proctor | 10600 | ph 9; Temp: 25 ° C | (1) ACD |
Biononerd Proctor | 3110 | ph 10; Temp: 25 ° C | (1) ACD |
(1) na-eji ihe nlereanya dị elu (ACD / Labs) software v11.02 (© 19913 ACD / Labs)
Kemikal
Aku | Baa uru | Onodu | Nsiputa |
Koc | 50200 | ph 1; Temp: 25 ° C | (1) ACD |
Koc | 1.71 x 105 | ph 2; Temp: 25 ° C | (1) ACD |
Koc | 2.26 x 105 | ph 3; Temp: 25 ° C | (1) ACD |
Koc | 2.34 x 105 | ph 4; Temp: 25 ° C | (1) ACD |
Koc | 2.34 x 105 | ph 5; Temp: 25 ° C | (1) ACD |
Koc | 2.29 x 105 | ph 6; Temp: 25 ° C | (1) ACD |
Koc | 1.88 x 105 | ph 7; Temp: 25 ° C | (1) ACD |
Aku | Baa uru | Onodu | Nsiputa |
Koc | 68000 | ph 8; Temp: 25 ° C | (1) ACD |
Koc | 11200 | ph 9; Temp: 25 ° C | (1) ACD |
Koc | 3260 | ph 10; Temp: 25 ° C | (1) ACD |
loda | 6.67 | ph 1; Temp: 25 ° C | (1) ACD |
loda | 7.21 | ph 2; Temp: 25 ° C | (1) ACD |
loda | 7.33 | ph 3; Temp: 25 ° C | (1) ACD |
loda | 7.34 | ph 4; Temp: 25 ° C | (1) ACD |
loda | 7.34 | ph 5; Temp: 25 ° C | (1) ACD |
loda | 7.33 | ph 6; Temp: 25 ° C | (1) ACD |
loda | 7.25 | ph 7; Temp: 25 ° C | (1) ACD |
loda | 6.80 | ph 8; Temp: 25 ° C | (1) ACD |
loda | 6.02 | ph 9; Temp: 25 ° C | (1) ACD |
loda | 5.49 | ph 10; Temp: 25 ° C | (1) ACD |
mkpokoro | 7.344 ± 0.723 | Temp: 25 ° C | (1) ACD |
Mass dị mma | 2.7 x 10-6 g / l | Temp: 25 ° C | (1) ACD |
Solubality | 1.2 x 10-5 g / l | ph 1; Temp: 25 ° C | (1) ACD |
Solubality | 3.7 x 10-6 g / l | ph 2; Temp: 25 ° C | (1) ACD |
Solubality | 2.8 x 10-6 g / l | ph 3; Temp: 25 ° C | (1) ACD |
Solubality | 2.8 x 10-6 g / l | ph 4; Temp: 25 ° C | (1) ACD |
Solubality | 2.8 x 10-6 g / l | ph 5; Temp: 25 ° C | (1) ACD |
Solubality | 2.8 x 10-6 g / l | ph 6; Temp: 25 ° C | (1) ACD |
Solubality | 3.4 x 10-6 g / l | ph 7; Temp: 25 ° C | (1) ACD |
Solubality | 9.6 x 10-6 g / l | ph 8; Temp: 25 ° C | (1) ACD |
Solubality | 5.7 x 10-5 g / l | ph 9; Temp: 25 ° C | (1) ACD |
Solubality | 1.9 x 10-4 g / l | ph 10; Temp: 25 ° C | (1) ACD |
Solubality | 3.4 x 10-6 g / l | Mmiri na-enweghị atụ nke ph 7.00; Temp: 25 ° C | (1) ACD |
Morlanic solubalic | 3.9 x 10-9 mol / l | Temp: 25 ° C | (1) ACD |
Akwara ike | 1.8 x 10-8 mol / l | ph 1; Temp: 25 ° C | (1) ACD |
Akwara ike | 5.4 x 10-9 mol / l | ph 2; Temp: 25 ° C | (1) ACD |
Akwara ike | 4.1 x 10-9 mol / l | ph 3; Temp: 25 ° C | (1) ACD |
Akwara ike | 4.0 x 10-9 mol / l | ph 4; Temp: 25 ° C | (1) ACD |
Akwara ike | 4.0 x 10-9 mol / l | ph 5; Temp: 25 ° C | (1) ACD |
Aku | Baa uru | Onodu | Nsiputa |
Akwara ike | 4.0 x 10-9 mol / l | ph 6; Temp: 25 ° C | (1) ACD |
Akwara ike | 4.9 x 10-9 mol / l | ph 7; Temp: 25 ° C | (1) ACD |
Akwara ike | 1.4 x 10-8 mol / l | ph 8; Temp: 25 ° C | (1) ACD |
Akwara ike | 8.3 x 10-8 mol / l | ph 9; Temp: 25 ° C | (1) ACD |
Akwara ike | 2.8 x 10-7 mol / l | ph 10; Temp: 25 ° C | (1) ACD |
Akwara ike | 4.9 x 10-9 mol / l | Mmiri na-enweghị atụ nke ph 7.00; Temp: 25 ° C | (1) ACD |
Molular ibu | 687.74 | ||
pica | 7.87 ± 0.43 | Ọtụtụ elekere acid: 25 Celsius C | (1) ACD |
pica | 1.39 ± 0.10 | Imirikiti temp: 25 Celsius C | (1) ACD |
(1) na-eji ihe nlereanya dị elu (ACD / Labs) software v11.02 (© 19913 ACD / Labs)
Keuju
Aku | Baa uru | Onodu | Nsiputa |
Keuju | 1.32 ± 0.1 g / cm3 | Temp: 20 Celsius C; Pịa: 760 Torr | (1) ACD |
Olu MUR | 518.5 ± 7.0 cm3 / mol | Temp: 20 Celsius C; Pịa: 760 Torr | (1) ACD |
(1) na-eji ihe nlereanya dị elu (ACD / Labs) software v11.02 (© 19913 ACD / Labs)
Lipinski
Aku | Baa uru | Onodu | Nsiputa |
Agbụ nke a na-efe efe | 12 | (1) ACD | |
Hing Na-anabata | 12 | (1) ACD | |
HOVOSS | 2 | (1) ACD | |
Hnyi onyinye / anabata | 14 | (1) ACD | |
mkpokoro | 7.344 ± 0.723 | Temp: 25 ° C | (1) ACD |
Molular ibu | 687.74 |
(1) na-eji ihe nlereanya dị elu (ACD / Labs) software v11.02 (© 19913 ACD / Labs)
Ọdịdị metụtara
Aku | Baa uru | Onodu | Nsiputa |
Mpaghara polar dị elu | 139 A2 | (1) ACD |
(1) na-eji ihe nlereanya dị elu (ACD / Labs) software v11.02 (© 19913 ACD / Labs)
Ihe nkiri dị
1h nmr
Ihe nkiri dị
13C nmr