![C41H41N5O8 adenosine, N-Benzoyl-5'-O-O-[Bis (4-Methoxyphenyl) Phenylmethyl] -2 '(2-methoxyethyl)-(9CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C41H41N5O8 adenosine, N-Benzoyl-5'-O-O-[Bis (4-Methoxyphenyl) Phenylmethyl] -2'- O- (2-methoxyethyl)-(9CI, ACI) Íomhá le feiceáil](https://cdn.globalso.com/nvchem/C41H41N5O8-Adenosine.jpg)
C41H41N5O8 adenosine, N-Benzoyl-5'-O-O-[Bis (4-Methoxyphenyl) Phenylmethyl] -2 '(2-methoxyethyl)-(9CI, ACI)
| Príomh -airíonna fisiceacha | Luach | Coinníollacha a chur le |
| Meáchan móilíneach | 731.79 | - |
| Leáphointe (turgnamhach) | 119-121 ° C. | - |
| Dlús (tuartha) | 1.31 ± 0.1 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr |
| PKA (tuartha) | 7.87 ± 0.43 | An luas is aigéid: 25 ° C. |
Smiles canónacha O = C (NC1 = NC = NC2 = C1N = CN2C3OC (COC (C = 4C = CC = CC4) (C5 = CC = C (OC) C = C5) C6 = CC = C (OC) C = C6) C (O) C3OCCOC) C = 7C = CC = CC = CC = CC7
Smiles isiméireach
C (OC [c@h] 1o [c@h] ([c@h] (occoc) [c @@ h] 1o) n2c = 3c (n = c2) = c (nc (= o) c4 = cc = cc = c4) n = cn3) (c5 = cc = c (oc)
= C6) c7 = cc = cc = c7
Orlach
Inchi = 1S/C41H41N5O8/C1-49-22-23-52-36-35 (47) 33 (54-40 (36) 46-26-44-34-37 (42-25-43-38 (34) 46) 45-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53-53) 41 (28-12-8-5-9-13-28,29-14-18-31 (50-2) 19-15-29) 30-16-20-32 (51-3) 21-17-30/H4-21,25-26,33,35-36,40,47H, 22-24H2,1-3H3, (H, 42,43,45,48)/T33-, 35-, 36-, 40-/M1/S1
Eochair Inchi
Kevmxgndtkpsmc-mumpvvmasa-n
16 ainmneacha eile don tsubstaint seo
N-Benzoyl-5′-O-O-[Bis (4-methoxyphenyl) phenylmethyl] -2′-o-o-o-(2-methoxyethyl) adenosine (ACI); 17: PN: US20030211606 Leathanach: 19 Seicheamh éilithe; 18: PN: US20040005569 Leathanach: 22 Seicheamh éilithe; 20: PN: US20040006030 Leathanach: 23 Seicheamh éilithe; 20: PN: US20040014047 Leathanach: 21 Seicheamh éilithe; 20: PN: US20040014049 Leathanach: 21 Seicheamh éilithe; 21: PN: US20040005570 PAG
E: 20 Seicheamh éilithe; 21: PN: US20040014048 Leathanach: 21 Seicheamh éilithe; 21: PN: US20040014050 Leathanach: 20 Seicheamh éilithe; 22: PN: US20040005565 Leathanach: 17- 22 Seicheamh éilithe; 22: PN: US20040014051 Leathanach: 23 Seicheamh éilithe; 23: PN: US20040 014699 Leathanach: 20 Seicheamh éilithe; 24: PN: US20040006029 Leathanach: 23 Seicheamh éilithe; 24: PN: WO03106645 Leathanach: 73 Seicheamh éilithe; 5′-DIMETHOXYTRITYL-2′-O-o-(2-methoxyethyl) -N6-Benzoyl adenosine; 95: PN: US20040005707 Leathanach: 20 Seicheamh Éilithe
| Airíonna atá ar fáil |
| Teirmeach |
Teirmeach
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Leáphointe | 119-121 ° C. | (1) CAS | |
(1) Penjarla, Srishylam; Nucleosides, nucleotides & aigéid núicléasacha, (2018), 37 (4), 232-247, Caplus
Speictrim ar fáil
1H NMR
13c NMR
| Airíonna atá ar fáil |
| Bitheolaíoch |
| Ceimiceán |
| Dlús |
| Lipinski |
| A bhaineann le struchtúr |
Bitheolaíoch
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Fachtóir bith -chomhchruinnithe | 31700 | pH 1; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.08 x 105 | pH 2; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.43 x 105 | pH 3; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.48 x 105 | pH 4; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.48 x 105 | pH 5; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.45 x 105 | pH 6; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.19 x 105 | pH 7; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 43000 | pH 8; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 7050 | pH 9; TEMP: 25 ° C. | (1) ACD |
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Fachtóir bith -chomhchruinnithe | 2060 | pH 10; TEMP: 25 ° C. | (1) ACD |
.
Ceimiceán
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| KOC | 37400 | pH 1; TEMP: 25 ° C. | (1) ACD |
| KOC | 1.28 x 105 | pH 2; TEMP: 25 ° C. | (1) ACD |
| KOC | 1.69 x 105 | pH 3; TEMP: 25 ° C. | (1) ACD |
| KOC | 1.74 x 105 | pH 4; TEMP: 25 ° C. | (1) ACD |
| KOC | 1.74 x 105 | pH 5; TEMP: 25 ° C. | (1) ACD |
| KOC | 1.71 x 105 | pH 6; TEMP: 25 ° C. | (1) ACD |
| KOC | 1.40 x 105 | pH 7; TEMP: 25 ° C. | (1) ACD |
| KOC | 50700 | pH 8; TEMP: 25 ° C. | (1) ACD |
| KOC | 8320 | pH 9; TEMP: 25 ° C. | (1) ACD |
| KOC | 2430 | pH 10; TEMP: 25 ° C. | (1) ACD |
| logáil | 6.44 | pH 1; TEMP: 25 ° C. | (1) ACD |
| logáil | 6.97 | pH 2; TEMP: 25 ° C. | (1) ACD |
| logáil | 7.09 | pH 3; TEMP: 25 ° C. | (1) ACD |
| logáil | 7.11 | pH 4; TEMP: 25 ° C. | (1) ACD |
| logáil | 7.11 | pH 5; TEMP: 25 ° C. | (1) ACD |
| logáil | 7.10 | pH 6; TEMP: 25 ° C. | (1) ACD |
| logáil | 7.01 | pH 7; TEMP: 25 ° C. | (1) ACD |
| logáil | 6.57 | pH 8; TEMP: 25 ° C. | (1) ACD |
| logáil | 5.78 | pH 9; TEMP: 25 ° C. | (1) ACD |
| logáil | 5.25 | pH 10; TEMP: 25 ° C. | (1) ACD |
| logáil | 7.109 ± 0.766 | TEMP: 25 ° C. | (1) ACD |
| Aifreann Intreach intreach | 5.6 x 10-6 g/l | TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 2.6 x 10-5 g/l | pH 1; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 7.3 x 10-6 g/L. | pH 2; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 5.8 x 10-6 g/l | pH 3; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 5.6 x 10-6 g/l | pH 4; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 5.6 x 10-6 g/l | pH 5; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 5.7 x 10-6 g/l | pH 6; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 7.0 x 10-6 g/l | pH 7; TEMP: 25 ° C. | (1) ACD |
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Aifreann tuaslagthachta | 1.9 x 10-5 g/l | pH 8; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 1.2 x 10-4 g/l | pH 9; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.0 x 10-4 g/l | pH 10; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 7.0 x 10-6 g/l | Uisce neamh -mhaolaithe pH 7.00; TEMP: 25 ° C. | (1) ACD |
| Intuaslagthacht intreach molar | 7.6 x 10-9 mol/l | TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 3.6 x 10-8 mol/l | pH 1; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 1.0 x 10-8 mol/l | pH 2; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.9 x 10-9 mol/l | pH 3; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.7 x 10-9 mol/l | pH 4; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.7 x 10-9 mol/l | pH 5; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.8 x 10-9 mol/l | pH 6; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 9.6 x 10-9 mol/l | pH 7; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 2.6 x 10-8 mol/l | pH 8; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 1.6 x 10-7 mol/l | pH 9; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 5.5 x 10-7 mol/l | pH 10; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 9.5 x 10-9 mol/l | Uisce neamh -mhaolaithe pH 7.00; TEMP: 25 ° C. | (1) ACD |
| Meáchan móilíneach | 731.79 | ||
| pka | 7.87 ± 0.43 | An luas is aigéid: 25 ° C. | (1) ACD |
| pka | 1.39 ± 0.10 | An luas is bunúsaí: 25 ° C. | (1) ACD |
.
Dlús
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Dlús | 1.31 ± 0.1 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
| Toirt molar | 556.9 ± 7.0 cm3/mol | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
.
Lipinski
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Bannaí rotatable faoi shaoirse | 15 | (1) ACD | |
| H Glacadóirí | 13 | (1) ACD | |
| Hontóirí H. | 2 | (1) ACD | |
| H suim deontóra/glacadóir | 15 | (1) ACD | |
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| logáil | 7.109 ± 0.766 | TEMP: 25 ° C. | (1) ACD |
| Meáchan móilíneach | 731.79 |
.
A bhaineann le struchtúr
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Achar dromchla polar | 148 A2 | (1) ACD | |
.
Speictrim ar fáil
1H NMR
13c NMR
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