![C39H37N5O7 Adenosina, N-benzoil-5′-O-[bis(4-metoxifenil)fenilmetil]-2′-O-metil- (9CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C39H37N5O7 Adenosina, N-benzoil-5′-O-[bis(4-metoxifenil)fenilmetil]-2′-O-metil- (9CI, ACI) Irudi nabarmendua](https://cdn.globalso.com/nvchem/Substance-Detail.jpg)
C39H37N5O7 Adenosina, N-benzoil-5′-O-[bis(4-metoxifenil)fenilmetil]-2′-O-metil- (9CI, ACI)
| Ezaugarri fisiko nagusiak | Balioa | Baldintza |
| Pisu molekularra | 687,74 | - |
| Dentsitatea (aurreikusita) | 1,32 ± 0,1 g/cm3 | Tenperatura: 20 °C; Presioa: 760 Torr |
| pKa (Aurreikusita) | 7,87 ± 0,43 | Tenperatura azidoena: 25 °C |
IRRIBARRE Kanonikoak 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)C3OC)C=7C=CC=CC7
IRRIBARRE ISOMERIKOAK
C(OC[C@H]1O[C@H]([C@H](OC)[C@@H]1O)N2C=3C(N=C2)=C(NC(=O)C4=CC=CC=C4)N=CN3)(C5=CC=C(OC)C=C5)(C6=CC=C(OC)C=C6) C7=CC=CC=C7
InChI
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)44-24-42-32-35(40-23-41-36(32)44)43-37(46)25-10-6-4-7-11-25/h4-21,23-24,31,33-34,38,45H,22H2,1-3H3,(H,40,41,43,46)/t31-,33-,
34-,38-/m1/s1
InChI gakoa
SARHDAQOZNKZCC-CJEGOSRCSA-N
Substantzia honen beste izen bat
N-Bentzoil-5′-O-[bis(4-metoxifenil)fenilmetil]-2′-O-metiladenosina (ACI)
Espektroak eskuragarri
1H NMR
13C NMR
Meza
Eskuragarri dauden propietateak
Biologikoa
Kimikoa
Dentsitatea
Lipinski
Egitura erlazionatua
Biologikoa
| Jabetza | Balioa | Baldintza | Iturria |
| Biokontzentrazio faktorea | 47800 | pH 1; Tenperatura: 25 °C | (1) ACD |
| Biokontzentrazio faktorea | 1,63 × 105 | pH 2; Tenperatura: 25 °C | (1) ACD |
| Biokontzentrazio faktorea | 2,16 × 105 | pH 3; Tenperatura: 25 °C | (1) ACD |
| Biokontzentrazio faktorea | 2,23 × 105 | pH 4; Tenperatura: 25 °C | (1) ACD |
| Biokontzentrazio faktorea | 2,23 × 105 | pH 5; Tenperatura: 25 °C | (1) ACD |
| Biokontzentrazio faktorea | 2,18 × 105 | pH 6; Tenperatura: 25 °C | (1) ACD |
| Biokontzentrazio faktorea | 1,79 x 105 | pH 7; Tenperatura: 25 °C | (1) ACD |
| Biokontzentrazio faktorea | 64900 | pH 8; Tenperatura: 25 °C | (1) ACD |
| Biokontzentrazio faktorea | 10600 | pH 9; Tenperatura: 25 °C | (1) ACD |
| Biokontzentrazio faktorea | 3110 | pH 10; Tenperatura: 25 °C | (1) ACD |
(1) Advanced Chemistry Development (ACD/Labs) Software V11.02 erabiliz kalkulatua (© 1994-2023 ACD/Labs)
Kimikoa
| Jabetza | Balioa | Baldintza | Iturria |
| Koc | 50200 | pH 1; Tenperatura: 25 °C | (1) ACD |
| Koc | 1,71 × 105 | pH 2; Tenperatura: 25 °C | (1) ACD |
| Koc | 2,26 × 105 | pH 3; Tenperatura: 25 °C | (1) ACD |
| Koc | 2,34 × 105 | pH 4; Tenperatura: 25 °C | (1) ACD |
| Koc | 2,34 × 105 | pH 5; Tenperatura: 25 °C | (1) ACD |
| Koc | 2,29 × 105 | pH 6; Tenperatura: 25 °C | (1) ACD |
| Koc | 1,88 x 105 | pH 7; Tenperatura: 25 °C | (1) ACD |
| Jabetza | Balioa | Baldintza | Iturria |
| Koc | 68000 | pH 8; Tenperatura: 25 °C | (1) ACD |
| Koc | 11200 | pH 9; Tenperatura: 25 °C | (1) ACD |
| Koc | 3260 | pH 10; Tenperatura: 25 °C | (1) ACD |
| logD | 6,67 | pH 1; Tenperatura: 25 °C | (1) ACD |
| logD | 7.21 | pH 2; Tenperatura: 25 °C | (1) ACD |
| logD | 7.33 | pH 3; Tenperatura: 25 °C | (1) ACD |
| logD | 7.34 | pH 4; Tenperatura: 25 °C | (1) ACD |
| logD | 7.34 | pH 5; Tenperatura: 25 °C | (1) ACD |
| logD | 7.33 | pH 6; Tenperatura: 25 °C | (1) ACD |
| logD | 7.25 | pH 7; Tenperatura: 25 °C | (1) ACD |
| logD | 6,80 | pH 8; Tenperatura: 25 °C | (1) ACD |
| logD | 6.02 | pH 9; Tenperatura: 25 °C | (1) ACD |
| logD | 5.49 | pH 10; Tenperatura: 25 °C | (1) ACD |
| logP | 7,344 ± 0,723 | Tenperatura: 25 °C | (1) ACD |
| Masaren berezko disolbagarritasuna | 2,7 x 10-6 g/L | Tenperatura: 25 °C | (1) ACD |
| Masa-disolbagarritasuna | 1,2 x 10-5 g/L | pH 1; Tenperatura: 25 °C | (1) ACD |
| Masa-disolbagarritasuna | 3,7 x 10-6 g/L | pH 2; Tenperatura: 25 °C | (1) ACD |
| Masa-disolbagarritasuna | 2,8 x 10-6 g/L | pH 3; Tenperatura: 25 °C | (1) ACD |
| Masa-disolbagarritasuna | 2,8 x 10-6 g/L | pH 4; Tenperatura: 25 °C | (1) ACD |
| Masa-disolbagarritasuna | 2,8 x 10-6 g/L | pH 5; Tenperatura: 25 °C | (1) ACD |
| Masa-disolbagarritasuna | 2,8 x 10-6 g/L | pH 6; Tenperatura: 25 °C | (1) ACD |
| Masa-disolbagarritasuna | 3,4 x 10-6 g/L | pH 7; Tenperatura: 25 °C | (1) ACD |
| Masa-disolbagarritasuna | 9,6 x 10-6 g/L | pH 8; Tenperatura: 25 °C | (1) ACD |
| Masa-disolbagarritasuna | 5,7 x 10-5 g/L | pH 9; Tenperatura: 25 °C | (1) ACD |
| Masa-disolbagarritasuna | 1,9 x 10-4 g/L | pH 10; Tenperatura: 25 °C | (1) ACD |
| Masa-disolbagarritasuna | 3,4 x 10-6 g/L | Tamperatu gabeko ura pH 7.00; Tenperatura: 25 °C | (1) ACD |
| Disolbagarritasun molar intrintsekoa | 3,9 x 10-9 mol/L | Tenperatura: 25 °C | (1) ACD |
| Disolbagarritasun molarra | 1,8 x 10-8 mol/L | pH 1; Tenperatura: 25 °C | (1) ACD |
| Disolbagarritasun molarra | 5,4 x 10-9 mol/L | pH 2; Tenperatura: 25 °C | (1) ACD |
| Disolbagarritasun molarra | 4,1 x 10-9 mol/L | pH 3; Tenperatura: 25 °C | (1) ACD |
| Disolbagarritasun molarra | 4,0 x 10-9 mol/L | pH 4; Tenperatura: 25 °C | (1) ACD |
| Disolbagarritasun molarra | 4,0 x 10-9 mol/L | pH 5; Tenperatura: 25 °C | (1) ACD |
| Jabetza | Balioa | Baldintza | Iturria |
| Disolbagarritasun molarra | 4,0 x 10-9 mol/L | pH 6; Tenperatura: 25 °C | (1) ACD |
| Disolbagarritasun molarra | 4,9 x 10-9 mol/L | pH 7; Tenperatura: 25 °C | (1) ACD |
| Disolbagarritasun molarra | 1,4 x 10-8 mol/L | pH 8; Tenperatura: 25 °C | (1) ACD |
| Disolbagarritasun molarra | 8,3 x 10-8 mol/L | pH 9; Tenperatura: 25 °C | (1) ACD |
| Disolbagarritasun molarra | 2,8 x 10-7 mol/L | pH 10; Tenperatura: 25 °C | (1) ACD |
| Disolbagarritasun molarra | 4,9 x 10-9 mol/L | Tamperatu gabeko ura pH 7.00; Tenperatura: 25 °C | (1) ACD |
| Pisu molekularra | 687,74 | ||
| pKa | 7,87 ± 0,43 | Tenperatura azidoena: 25 °C | (1) ACD |
| pKa | 1,39 ± 0,10 | Oinarrizko tenperatura: 25 °C | (1) ACD |
(1) Advanced Chemistry Development (ACD/Labs) Software V11.02 erabiliz kalkulatua (© 1994-2023 ACD/Labs)
Dentsitatea
| Jabetza | Balioa | Baldintza | Iturria |
| Dentsitatea | 1,32 ± 0,1 g/cm3 | Tenperatura: 20 °C; Presioa: 760 Torr | (1) ACD |
| Bolumen molarra | 518,5 ± 7,0 cm3/mol | Tenperatura: 20 °C; Presioa: 760 Torr | (1) ACD |
(1) Advanced Chemistry Development (ACD/Labs) Software V11.02 erabiliz kalkulatua (© 1994-2023 ACD/Labs)
Lipinski
| Jabetza | Balioa | Baldintza | Iturria |
| Libreki bira daitezkeen bonuak | 12 | (1) ACD | |
| H hartzailea | 12 | (1) ACD | |
| H Emaileak | 2 | (1) ACD | |
| H Emaile/Hartzaile Batura | 14 | (1) ACD | |
| logP | 7,344 ± 0,723 | Tenperatura: 25 °C | (1) ACD |
| Pisu molekularra | 687,74 |
(1) Advanced Chemistry Development (ACD/Labs) Software V11.02 erabiliz kalkulatua (© 1994-2023 ACD/Labs)
Egitura erlazionatua
| Jabetza | Balioa | Baldintza | Iturria |
| Azalera polarra | 139 A2 | (1) ACD | |
(1) Advanced Chemistry Development (ACD/Labs) Software V11.02 erabiliz kalkulatua (© 1994-2023 ACD/Labs)
Espektroak eskuragarri
1H NMR
Espektroak eskuragarri
13C NMR
![C42H52N5O9P Zitidina, N-azetil-5′ -O- [bis(4-metoxifenil)fenilmetil]-2′ -O- metil-, 3′ – [2-zianoetil N,N-bis(1-metiletil)fosforamidita] (ACI)](https://cdn.globalso.com/nvchem/C42H52N5O9P-Cytidine-300x300.png)
![C9H10N2O5 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pirimidin-6-ona, 2,3,3a,9a-tetrahidro-3-hidroxi-2-(hidroximetil)-, (2R,3R,3aS,9aR)- (9CI, ACI)](https://cdn.globalso.com/nvchem/C9H10N2O5-6H-Furo-300x300.png)
![C53H66N7O8PSi CAS zk.: 104992-55-4 Adenosina, N-bentzoil-5′ -O- [bis(4-metoxifenil)fenilmetil]-2′ – O- [(1,1-dimetiletil)dimetilsilil]-, 3′ – [2-zianoetil N,N-bis(1-metiletil)...](https://cdn.globalso.com/nvchem/C53H66N7O8PSi-300x300.png)
![C31H30N2O7 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pirimidin-6-ona, 2-[[bis(4-metoxifenil)fenilmetoxi]metil]-2,3,3a,9a-tetrahidro-3-hidroxi-7-metil-, (2R,3R,3aS,9aR)- (9CI, ACI)](https://cdn.globalso.com/nvchem/C31H30N2O7-6H-Furo-300x300.jpg)
![C44H53FN7O8 Guanosina, 5′ -O- [bis(4-metoxifenil)fenilmetil]-2′ -desoxi-2′ – fluoro-N-(2-metil-1-oxopropil)-, 3′ – [2-zianoetil N,N-bis(1-metil etil)fosforamidita] (ACI)](https://cdn.globalso.com/nvchem/C44H53FN7O8-300x300.png)
![118 Re36H44N2O8Si Uridina, 5′-O-[bis(4-metoxifenil)fenilmetil]-2′-O-[(1,1- dimetiletil)dimetilsilil]- (9CI, ACI)](https://cdn.globalso.com/nvchem/118-Re36H44N2O8Si-Uridine-300x300.jpg)