![C41H41N5O8 adenosina, n-benzoyl-5'-o- [bis (4-metoxyphenyl) fenilmetiloa] -2'- o- (2-metoxyetil) - (9ci, aci)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C41H41N5O8 adenosina, n-benzoyl-5'-o- [bis (4-metoxyphenyl) fenilmetilia] -2'- o- (2-metoxyetil) - (9ci, aci) Nabarmendutako irudia](https://cdn.globalso.com/nvchem/C41H41N5O8-Adenosine.jpg)
C41H41N5O8 adenosina, n-benzoyl-5'-o- [bis (4-metoxyphenyl) fenilmetiloa] -2'- o- (2-metoxyetil) - (9ci, aci)
| Ezaugarri fisikoak funtsezkoak | Balio | Baldintza |
| Pisu molekularra | 731,79 | - |
| Urtzeko puntua (esperimentala) | 119-121 ° C | - |
| Dentsitatea (aurreikusitakoa) | 1,31 ± 0,1 g / cm3 | Temp: 20 ° C; Prentsa: 760 Torr |
| pka (aurreikusita) | 7,87 ± 0,43 | Gai azido gehienak: 25 ° C |
Irribarre kanonikoak o = c (nc1 = nc = nc2 = cn2c3oc (coc (c = cc = cc) c = c5) c6 = cc = c (oc) c = c6) c (o) c3occoc) c = 7c = cc = cc7
Irribarre isomerikoak
C (oc [c @ h] 1o [[c @ h] ([c @ h] [c @ h] 1o) [c @ h] 1o) n = nc (= o) c4 = cc = cc) (c5 = cc = c (cc) (c6 = cc = c (oc) c
= C6) C7 = CC = CC = C7
Inchi
Inchi = 1s / c41h41n5o8 / c1-49-22-23-52-36-35 (47) 33 (47) 46-26-44-34-37 (42-25-43-38 (34-25-43-38 (34) 46) 45-39 (48) 27-10-6-4-7-11-6-4-7-11-27) 24-53- 41 (28-12-5-5-28-13-28,29-14-18-31 (50-2) 19-15-29) 30-16-20-32 (51-3) 21-17-30-30 / h4-21,25-26,33,35-36,40,33,1-3h3, 22-24h2,1-3h3, (H, 42,43,45,48) / t33-, 35-, 36-, 40- / m1 / s1
Inchi gakoa
Kevmxgndtkpsmc-mumpvvmama-n
16 substantzia honetarako beste izen batzuk
N-benzoyl-5'-o- [BIS (4-metoxyphenyl) fenilmetilia] -2'-o- (2-metoxyetil) adenosina (ACI); 17: PN: US20030211606 Page: 19 erreklamatutako sekuentzia; 18: PN: US2004000569 Page: 22 Sekuentzia erreklamatua; 20: Pn: US20040006030 Page: 23 erreklamatutako sekuentzia; 20: PN: US20040014047 Page: 21 Sekuentzia erreklamatua; 20: PN: US20040014049 Page: 21 erreklamatutako sekuentzia; 21: Pn: US2004000570 pag
E: 20 erreklamatutako sekuentzia; 21: Pn: US20040014048 Page: 21 erreklamatutako sekuentzia; 21: Pn: US20040014050 Page: 20 erreklamatutako sekuentzia; 22: PN: US2004000565 Page: 17-2 22 erreklamatutako sekuentzia; 22: PN: US20040014051 Page: 23 Sekuentzia erreklamatua; 23: Pn: US20040 014699 Page: 20 erreklamatutako sekuentzia; 24: PN: US20040006029 Page: 23 erreklamatutako sekuentzia; 24: PN: WO03106645 Page: 73 erreklamatutako sekuentzia; 5'-dimetoxytrityl-2'-o- (2-metoxyetil) -n6-benzoyl adenosina; 95: PN: US20040005707 Page: 20 erreklamatutako sekuentzia
| Ezaugarriak eskuragarri |
| Termal |
Termal
| Jabetasun | Balio | Baldintza | Iturri |
| Urtzeko puntua | 119-121 ° C | (1) CAS | |
(1) Penjarla, Srishylam; Nukleoak, nukleotidoak eta azido nukleikoak, (2018), 37 (4), 232-247, Caplus
Espektroak eskuragarri
1h nmr
13C NMR
| Ezaugarriak eskuragarri |
| Biologiko |
| Gai kimiko |
| Dentsitate |
| Lipinski |
| Egitura erlazionatua |
Biologiko
| Jabetasun | Balio | Baldintza | Iturri |
| Bioconcentration faktorea | 31700 | pH 1; Temp: 25 ° C | (1) ACD |
| Bioconcentration faktorea | 1.08 x 105 | PH 2; Temp: 25 ° C | (1) ACD |
| Bioconcentration faktorea | 1,43 x 105 | pH 3; Temp: 25 ° C | (1) ACD |
| Bioconcentration faktorea | 1,48 x 105 | PH 4; Temp: 25 ° C | (1) ACD |
| Bioconcentration faktorea | 1,48 x 105 | PH 5; Temp: 25 ° C | (1) ACD |
| Bioconcentration faktorea | 1,45 x 105 | PH 6; Temp: 25 ° C | (1) ACD |
| Bioconcentration faktorea | 1.19 x 105 | PH 7; Temp: 25 ° C | (1) ACD |
| Bioconcentration faktorea | 43000 | PH 8; Temp: 25 ° C | (1) ACD |
| Bioconcentration faktorea | 7050 | PH 9; Temp: 25 ° C | (1) ACD |
| Jabetasun | Balio | Baldintza | Iturri |
| Bioconcentration faktorea | 2060 | pH 10; Temp: 25 ° C | (1) ACD |
(1) Kimika aurreratua garatzea (ACD / LABS) softwarea erabiliz kalkulatuta (© 1994-2023 ACD / Labs)
Gai kimiko
| Jabetasun | Balio | Baldintza | Iturri |
| 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 |
| sintika | 6,44 | pH 1; Temp: 25 ° C | (1) ACD |
| sintika | 6,99 | PH 2; Temp: 25 ° C | (1) ACD |
| sintika | 7.09 | pH 3; Temp: 25 ° C | (1) ACD |
| sintika | 71011 | PH 4; Temp: 25 ° C | (1) ACD |
| sintika | 71011 | PH 5; Temp: 25 ° C | (1) ACD |
| sintika | 7.10 | PH 6; Temp: 25 ° C | (1) ACD |
| sintika | 7.01 | PH 7; Temp: 25 ° C | (1) ACD |
| sintika | 6,57 | PH 8; Temp: 25 ° C | (1) ACD |
| sintika | 5,98 | PH 9; Temp: 25 ° C | (1) ACD |
| sintika | 525 | pH 10; Temp: 25 ° C | (1) ACD |
| logpp | 7.109 ± 0,766 | Temp: 25 ° C | (1) ACD |
| Intrinsic disolbagarritasuna | 5.6 x 10-6 g / l | Temp: 25 ° C | (1) ACD |
| Disolbagarritasun masiboa | 2,6 x 10-5 g / l | pH 1; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun masiboa | 7,3 x 10-6 g / l | PH 2; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun masiboa | 5,8 x 10-6 g / l | pH 3; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun masiboa | 5.6 x 10-6 g / l | PH 4; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun masiboa | 5.6 x 10-6 g / l | PH 5; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun masiboa | 5,7 x 10-6 g / l | PH 6; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun masiboa | 7,0 x 10-6 g / l | PH 7; Temp: 25 ° C | (1) ACD |
| Jabetasun | Balio | Baldintza | Iturri |
| Disolbagarritasun masiboa | 1,9 x 10-5 g / l | PH 8; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun masiboa | 1.2 x 10-4 g / l | PH 9; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun masiboa | 4.0 x 10-4 g / l | pH 10; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun masiboa | 7,0 x 10-6 g / l | URAREN PHIKOA 7,00; Temp: 25 ° C | (1) ACD |
| Molar berezko disolbagarritasuna | 7,6 x 10-9 mol / l | Temp: 25 ° C | (1) ACD |
| Disolbagarritasun molarra | 3,6 x 10-8 mol / l | pH 1; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun molarra | 1.0 x 10-8 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun molarra | 7,9 x 10-9 mol / l | pH 3; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun molarra | 7,7 x 10-9 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun molarra | 7,7 x 10-9 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun molarra | 7,8 x 10-9 mol / l | PH 6; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun molarra | 9,6 x 10-9 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun molarra | 2,6 x 10-8 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun molarra | 1,6 x 10-7 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun molarra | 5,5 x 10-7 mol / l | pH 10; Temp: 25 ° C | (1) ACD |
| Disolbagarritasun molarra | 9,5 x 10-9 mol / l | URAREN PHIKOA 7,00; Temp: 25 ° C | (1) ACD |
| Pisu molekularra | 731,79 | ||
| pka | 7,87 ± 0,43 | Gai azido gehienak: 25 ° C | (1) ACD |
| pka | 1,39 ± 0,10 | Oinarrizko tenperatura: 25 ° C | (1) ACD |
(1) Kimika aurreratua garatzea (ACD / LABS) softwarea erabiliz kalkulatuta (© 1994-2023 ACD / Labs)
Dentsitate
| Jabetasun | Balio | Baldintza | Iturri |
| Dentsitate | 1,31 ± 0,1 g / cm3 | Temp: 20 ° C; Prentsa: 760 Torr | (1) ACD |
| Bolumen molarra | 556,9 ± 7,0 cm3 / mol | Temp: 20 ° C; Prentsa: 760 Torr | (1) ACD |
(1) Kimika aurreratua garatzea (ACD / LABS) softwarea erabiliz kalkulatuta (© 1994-2023 ACD / Labs)
Lipinski
| Jabetasun | Balio | Baldintza | Iturri |
| Lotura libreki birakariak | 15 | (1) ACD | |
| H Onartzaileak | 13 | (1) ACD | |
| H Emaileak | 2 | (1) ACD | |
| H emaile / onartzaileen batura | 15 | (1) ACD | |
| Jabetasun | Balio | Baldintza | Iturri |
| logpp | 7.109 ± 0,766 | Temp: 25 ° C | (1) ACD |
| Pisu molekularra | 731,79 |
(1) Kimika aurreratua garatzea (ACD / LABS) softwarea erabiliz kalkulatuta (© 1994-2023 ACD / Labs)
Egitura erlazionatua
| Jabetasun | Balio | Baldintza | Iturri |
| Azalera polarra | 148 A2 | (1) ACD | |
(1) Kimika aurreratua garatzea (ACD / LABS) softwarea erabiliz kalkulatuta (© 1994-2023 ACD / Labs)
Espektroak eskuragarri
1h nmr
13C NMR
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