C17h25n5o7 Guanosin, 2'-o- (2-Methohyl) -N- (2-Methyl-1-oxopropyl) - (9 -opropyl)
| Schlëssel kierperlech Eegeschafte | Wäert | Bedingchmëttel |
| Molekular Gewiicht | 411.41 | - |
| Schmelzen Punkt (experimentell) | 137-139.2 ° C | - |
| Dicht (virausgesot) | 1.60 ± 0,1 g / cm3 | Trëpp: 20 ° C; Press: 760 Torr |
| pka (virausgesot) | 8.68 ± 0,20 | Meescht sauer Tempo: 25 ° C |
Canonical Laachen O = C1N = C (NC (= O) c (c) c) NC2 = C1n = CN2C3OC (CO) C) C) C) C) CS) C) C) C) C) C) C) C) c
ISOMRIC SMILE O = C1C2 = C (N (C2) [C @ H] 3 [C @ h] (OCCoc) [CA) (CC (CC (CC (CC (CC (CC (CA)
Inchi
Inchi = 1-23) 29-16 / H7-9,1,11-19-10 (15.23) 18-7) 18,7) 162 (13,7/29 (13.7-52 (28-523 (6-23) 29-16-) 14.11-191.16,23- 24h, 4-6h2.1-3h3, (H2,20.20.25.25.26) / T9-, 12-, 12- / M1 / S1
Inchi Schlëssel
IZoogjiuchaychay-Ubedbupssa-n
1 aneren Numm fir dës Substanz
2'-o- (2-methoryethyl) -n- (2-Methyl-1-Oxopropyl) Guanosin (ACI)
| Eegeschafte verfügbar |
| Thermesch |
Thermesch
| Prowalange | Wäert | Bedingchmëttel | Quellatioun |
| Schmëlzpunkt | 137-139.2 ° C | (1) Cas | |
(1) Taj, Shubir Ali S.; Nukleods, Canleotiden & Käre-Säuren, (2008), 27 (9), 1024-10333, Capplang
Spektre verfügbar
1h nmr
13c nmr
IR
| Eegeschafte verfügbar |
| Biologesch |
| Chemeschen |
| Dicht |
| Lipinski |
| Struktur verbonnen |
Biologesch
| Prowalange | Wäert | Bedingchmëttel | Quellatioun |
| BIKOCONSENTRATIOUN FIELD | 1.0 | pH 1; Temp: 25 ° C | (1) ACD |
| BIKOCONSENTRATIOUN FIELD | 1.0 | pH 2; Temp: 25 ° C | (1) ACD |
| BIKOCONSENTRATIOUN FIELD | 1.0 | pH 3; Temp: 25 ° C | (1) ACD |
| BIKOCONSENTRATIOUN FIELD | 1.0 | pH 4; Temp: 25 ° C | (1) ACD |
| BIKOCONSENTRATIOUN FIELD | 1.0 | pH 5; Temp: 25 ° C | (1) ACD |
| BIKOCONSENTRATIOUN FIELD | 1.0 | pH 6; Temp: 25 ° C | (1) ACD |
| BIKOCONSENTRATIOUN FIELD | 1.0 | pH 7; Temp: 25 ° C | (1) ACD |
| BIKOCONSENTRATIOUN FIELD | 1.0 | pH 8; Temp: 25 ° C | (1) ACD |
| BIKOCONSENTRATIOUN FIELD | 1.0 | pH 9; Temp: 25 ° C | (1) ACD |
| BIKOCONSENTRATIOUN FIELD | 1.0 | ph 10; Temp: 25 ° C | (1) ACD |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Chemeschen
| Prowalange | Wäert | Bedingchmëttel | Quellatioun |
| Kokéieren | 1.0 | pH 1; Temp: 25 ° C | (1) ACD |
| Kokéieren | 1.01 | pH 2; Temp: 25 ° C | (1) ACD |
| Kokéieren | 5.81 | pH 3; Temp: 25 ° C | (1) ACD |
| Kokéieren | 11.4 | pH 4; Temp: 25 ° C | (1) ACD |
| Kokéieren | 12.6 | pH 5; Temp: 25 ° C | (1) ACD |
| Kokéieren | 12,7 | pH 6; Temp: 25 ° C | (1) ACD |
| Kokéieren | 12,5 | pH 7; Temp: 25 ° C | (1) ACD |
| Kokéieren | 10.6 | pH 8; Temp: 25 ° C | (1) ACD |
| Kokéieren | 4.20 | pH 9; Temp: 25 ° C | (1) ACD |
| Kokéieren | 1.0 | ph 10; Temp: 25 ° C | (1) ACD |
| Aloggenlogt | -2.44 | pH 1; Temp: 25 ° C | (1) ACD |
| Aloggenlogt | -1,60 | pH 2; Temp: 25 ° C | (1) ACD |
| Aloggenlogt | -0,84 | pH 3; Temp: 25 ° C | (1) ACD |
| Aloggenlogt | -0,55 | pH 4; Temp: 25 ° C | (1) ACD |
| Aloggenlogt | -0,50 | pH 5; Temp: 25 ° C | (1) ACD |
| Aloggenlogt | -0,50 | pH 6; Temp: 25 ° C | (1) ACD |
| Aloggenlogt | -0.51 | pH 7; Temp: 25 ° C | (1) ACD |
| Aloggenlogt | -0,58 | pH 8; Temp: 25 ° C | (1) ACD |
| Aloggenlogt | -0,99 | pH 9; Temp: 25 ° C | (1) ACD |
| Aloggenlogt | -1.76 | ph 10; Temp: 25 ° C | (1) ACD |
| AloggenO Aloggen | -0,497 ± 0,633 | Temp: 25 ° C | (1) ACD |
| Mass intrinsesch Solubilitéit | 0,58 g / l | Temp: 25 ° C | (1) ACD |
| Massebelibilitéit | 49 g / l | pH 1; Temp: 25 ° C | (1) ACD |
| Massebelibilitéit | 7.0 g / l | pH 2; Temp: 25 ° C | (1) ACD |
| Massebelibilitéit | 1.2 g / l | pH 3; Temp: 25 ° C | (1) ACD |
| Massebelibilitéit | 0,62 g / l | pH 4; Temp: 25 ° C | (1) ACD |
| Massebelibilitéit | 0,58 g / l | pH 5; Temp: 25 ° C | (1) ACD |
| Massebelibilitéit | 0,58 g / l | pH 6; Temp: 25 ° C | (1) ACD |
| Massebelibilitéit | 0,58 g / l | pH 7; Temp: 25 ° C | (1) ACD |
| Massebelibilitéit | 0,70 g / l | pH 8; Temp: 25 ° C | (1) ACD |
| Massebelibilitéit | 1.7 g / l | pH 9; Temp: 25 ° C | (1) ACD |
| Massebelibilitéit | 10 g / l | ph 10; Temp: 25 ° C | (1) ACD |
| Prowalange | Wäert | Bedingchmëttel | Quellatioun |
| Massebelibilitéit | 0,58 g / l | UNBUFFERERT WATER PH 5.98; Temp: 25 ° C | (1) ACD |
| Molar intrinsesch Solubilitéit | 1.4 x 10-3 Mol / l | Temp: 25 ° C | (1) ACD |
| Molar sublabilitéit | 0,12 MOL / L | pH 1; Temp: 25 ° C | (1) ACD |
| Molar sublabilitéit | 0,017 MOL / L | pH 2; Temp: 25 ° C | (1) ACD |
| Molar sublabilitéit | 3.0 x 10-3 Mol / l | pH 3; Temp: 25 ° C | (1) ACD |
| Molar sublabilitéit | 1,5 x 10-3 Mol / l | pH 4; Temp: 25 ° C | (1) ACD |
| Molar sublabilitéit | 1.4 x 10-3 Mol / l | pH 5; Temp: 25 ° C | (1) ACD |
| Molar sublabilitéit | 1.4 x 10-3 Mol / l | pH 6; Temp: 25 ° C | (1) ACD |
| Molar sublabilitéit | 1.4 x 10-3 Mol / l | pH 7; Temp: 25 ° C | (1) ACD |
| Molar sublabilitéit | 1.7 x 10-3 Mol / l | pH 8; Temp: 25 ° C | (1) ACD |
| Molar sublabilitéit | 4.2 X 10-3 Mol / l | pH 9; Temp: 25 ° C | (1) ACD |
| Molar sublabilitéit | 0,025 MOL / L | ph 10; Temp: 25 ° C | (1) ACD |
| Molar sublabilitéit | 1.4 x 10-3 Mol / l | UNBUFFERERT WATER PH 5.98; Temp: 25 ° C | (1) ACD |
| Molekular Gewiicht | 411.41 | ||
| paka | 8.68 ± 0,20 | Meescht sauer Tempo: 25 ° C | (1) ACD |
| paka | 3.05 ± 0,20 | Déi meescht Basis Tempo: 25 ° C | (1) ACD |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Dicht
| Prowalange | Wäert | Bedingchmëttel | Quellatioun |
| Dicht | 1.60 ± 0,1 g / cm3 | Trëpp: 20 ° C; Press: 760 Torr | (1) ACD |
| Molar Volumen | 256.2 ± 7.0 cm3 / Mol | Trëpp: 20 ° C; Press: 760 Torr | (1) ACD |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Lipinski
| Prowalange | Wäert | Bedingchmëttel | Quellatioun |
| Fräi rotativ Obligatiounen | 9 | (1) ACD | |
| H Akzeptoren | 12 | (1) ACD | |
| H Donateuren | 4 | (1) ACD | |
| H Spender / Acceptor Zomm | 16 | (1) ACD | |
| AloggenO Aloggen | -0,497 ± 0,633 | Temp: 25 ° C | (1) ACD |
| Molekular Gewiicht | 411.41 |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Struktur verbonnen
| Prowalange | Wäert | Bedingchmëttel | Quellatioun |
| Polarfläch | 157 A2 | (1) ACD | |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Spektre verfügbar
1h nmr
13c nmr
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