C15H21N5O6 GUANOSINE, 2′-O-METHYL-N- (2-metýl-1-oxóprópýl)-(9ci, ACI)
| Lykilatriði eðlisfræðilegra eiginleika | Gildi | Ástand |
| Mólmassa | 367.36 | - |
| Þéttleiki (spáð) | 1,68 ± 0,1 g/cm3 | Temp: 20 ° C; Press: 760 Torr |
| PKA (spáð) | 9,16 ± 0,20 | Sýrtasta temp: 25 ° C |
Canonical bros O = C1N = C (NC (= O) C (C) C) NC2 = C1N = CN2C3OC (CO) C (O) C3OC
Isomeric bros O (C) [C@H] 1 [C@H] (N2C3 = C (N = C2) C (= O) N = C (NC (C (C) C) = O) N3) O [C@H] (CO) [C@H] 1O
Tommur
Inchi = 1s/C15H21N5O6/C1-6 (2) 12 (23) 18-15-17-11-8 (13 (24) 19-15) 16-5-20 (11) 14-10 (25-3) 9 (22) 7 (4-21) 26-14/H5-7,9-10,14,21- 22H, 4H2,1-3H3, (H2,17,18,19,23,24)/T7-, 9-, 10-, 14-/m1/s1
Inchi lykill
Rpulcyxeyodqog-akaijsegsa-n
2 önnur nöfn fyrir þetta efni
2′-O-Metýl-N-(2-metýl-1-oxóprópýl) guanósín (ACI);N2-isobutyryl-2′-O-metýlguanósín
Litróf í boði
1H NMR
13c nmr
Messa
| Eignir í boði |
| Líffræðileg |
| Efni |
| Þéttleiki |
| Lipinski |
| Uppbygging tengd |
Líffræðileg
| Eign | Gildi | Ástand | Uppspretta |
| Bioconcentration Factor | 1.0 | pH 1; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 2; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1.0 | Ph 3; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 4; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 5; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 6; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 7; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 8; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 9; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 10; Temp: 25 ° C. | (1) ACD |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Efni
| Eign | Gildi | Ástand | Uppspretta |
| KOC | 2.12 | pH 1; Temp: 25 ° C. | (1) ACD |
| KOC | 8.67 | pH 2; Temp: 25 ° C. | (1) ACD |
| KOC | 12.6 | Ph 3; Temp: 25 ° C. | (1) ACD |
| KOC | 13.3 | pH 4; Temp: 25 ° C. | (1) ACD |
| KOC | 13.3 | pH 5; Temp: 25 ° C. | (1) ACD |
| KOC | 13.3 | pH 6; Temp: 25 ° C. | (1) ACD |
| KOC | 13.2 | pH 7; Temp: 25 ° C. | (1) ACD |
| Eign | Gildi | Ástand | Uppspretta |
| KOC | 12.5 | pH 8; Temp: 25 ° C. | (1) ACD |
| KOC | 7.85 | pH 9; Temp: 25 ° C. | (1) ACD |
| KOC | 1.76 | pH 10; Temp: 25 ° C. | (1) ACD |
| logd | -1.26 | pH 1; Temp: 25 ° C. | (1) ACD |
| logd | -0,65 | pH 2; Temp: 25 ° C. | (1) ACD |
| logd | -0,49 | Ph 3; Temp: 25 ° C. | (1) ACD |
| logd | -0,47 | pH 4; Temp: 25 ° C. | (1) ACD |
| logd | -0,46 | pH 5; Temp: 25 ° C. | (1) ACD |
| logd | -0,46 | pH 6; Temp: 25 ° C. | (1) ACD |
| logd | -0,47 | pH 7; Temp: 25 ° C. | (1) ACD |
| logd | -0,49 | pH 8; Temp: 25 ° C. | (1) ACD |
| logd | -0,69 | pH 9; Temp: 25 ° C. | (1) ACD |
| logd | -1.34 | pH 10; Temp: 25 ° C. | (1) ACD |
| logp | -0,464 ± 0,636 | Temp: 25 ° C. | (1) ACD |
| Massa eðlislægni | 0,55 g/l | Temp: 25 ° C. | (1) ACD |
| Massa leysni | 3,5 g/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 0,84 g/l | pH 2; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 0,59 g/l | Ph 3; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 0,55 g/l | pH 4; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 0,55 g/l | pH 5; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 0,55 g/l | pH 6; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 0,55 g/l | pH 7; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 0,59 g/l | pH 8; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 0,96 g/l | pH 9; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 4,4 g/l | pH 10; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 0,55 g/l | Óbifað vatn pH 6,00; Temp: 25 ° C. | (1) ACD |
| Molar innri leysni | 1,5 x 10-3 mól/l | Temp: 25 ° C. | (1) ACD |
| Molar leysni | 9,6 x 10-3 mól/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 2,3 x 10-3 mól/l | pH 2; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,6 x 10-3 mól/l | Ph 3; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,5 x 10-3 mól/l | pH 4; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,5 x 10-3 mól/l | pH 5; Temp: 25 ° C. | (1) ACD |
| Eign | Gildi | Ástand | Uppspretta |
| Molar leysni | 1,5 x 10-3 mól/l | pH 6; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,5 x 10-3 mól/l | pH 7; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,6 x 10-3 mól/l | pH 8; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 2,6 x 10-3 mól/l | pH 9; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 0,012 mól/l | pH 10; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,5 x 10-3 mól/l | Óbifað vatn pH 6,00; Temp: 25 ° C. | (1) ACD |
| Mólmassa | 367.36 | ||
| PKA | 9,16 ± 0,20 | Sýrtasta temp: 25 ° C | (1) ACD |
| PKA | 1,73 ± 0,10 | Grundvöllurinn: 25 ° C | (1) ACD |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Þéttleiki
| Eign | Gildi | Ástand | Uppspretta |
| Þéttleiki | 1,68 ± 0,1 g/cm3 | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
| Mólmagn | 217,6 ± 7,0 cm3/mól | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Eign | Gildi | Ástand | Uppspretta |
| Frjálslega snúningsbönd | 6 | (1) ACD | |
| H samþykki | 11 | (1) ACD | |
| H styrktaraðilar | 4 | (1) ACD | |
| H gjafa/samþykki fjárhæð | 15 | (1) ACD | |
| logp | -0,464 ± 0,636 | Temp: 25 ° C. | (1) ACD |
| Mólmassa | 367.36 |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Uppbygging tengd
| Eign | Gildi | Ástand | Uppspretta |
| Polar yfirborð | 147 A2 | (1) ACD | |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Litróf í boði
1H NMR
Litróf í boði
13c nmr
![C38H49NO7 1- pýrrólidíndódekanósýru, 2- [[bis (4-metoxýfenýl) fenýlm etoxý] metýl] -4-hýdroxý-λ-oxó-, (2s, 4R)-(ACI)](https://cdn.globalso.com/nvchem/C38H49NO7-1-Pyrrolidinedodecanoic-acid-300x300.jpg)
![C39H37N5O7 adenósín, N-bensóýl-5′-O- [BIS (4-metoxýfenýl) fenýlmetýl] -2′- O-metýl- (9ci, ACI)](https://cdn.globalso.com/nvchem/Substance-Detail-300x300.jpg)
![C13H13NO5 1H-Pyrano [3,4-F] Indolizine-3,6,10 (4H) -Tririane, 4-etýl-7,8-díhýdró-4- hýdroxý-, (4s)-(9ci, ACI) H319, H302](https://cdn.globalso.com/nvchem/C13H13NO5-1H-Pyrano-300x300.jpg)
![C44H53FN7O8 Guanosine, 5 ′ -O- [Bis (4-metoxýfenýl) fenýlmetýl] -2 ′ -Deoxý-2 ′-Fluoro-N- (2-metýl-1-oxóprópýl)-, 3 ′-[2-cýanóetýl N, N-BIS (1-metýl etýl) fosforidite] (aci)](https://cdn.globalso.com/nvchem/C44H53FN7O8-300x300.png)
![C36H39N5O8 guanosine, 5′-O- [BIS (4-metoxýfenýl) fenýlmetýl] -2′-O-metýl-N- (2-metýl-1-oxóprópýl)-(9ci, ACI)](https://cdn.globalso.com/nvchem/C36H39N5O8-Guanosine-300x300.jpg)
![C34H39N3O8 CYTIDINE, 5′-O- [BIS (4-metoxýfenýl) fenýlmetýl] -2′-O- (2-metox yethyl) -5-metýl- (9ci, ACI)](https://cdn.globalso.com/nvchem/C34H39N3O8-Cytidine-300x300.jpg)