![Guanóisín C41H51N5O8Si, 5′-O-[bis(4-methocsaifeinil)feanilmheitil]-2′-O-[(1,1- démheitiolaitil)démheitil-démheitil]-N-(2-meitil-1-ocsapróipil)- (9CI, ACI )](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![Guanóisín C41H51N5O8Si, 5′-O-[bis(4-methocsaifeinil)feanilmheitil]-2′-O-[(1,1- démheitiolaitil)démheitil-démheitil]-N-(2-meitil-1-ocsapróipil)- (9CI, ACI ) Íomhá Réadmhaoin](https://cdn.globalso.com/nvchem/C41H51N5O8Si-Guanosine.jpg)
Guanóisín C41H51N5O8Si, 5′-O-[bis(4-methocsaifeinil)feanilmheitil]-2′-O-[(1,1- démheitiolaitil)démheitil-démheitil]-N-(2-meitil-1-ocsapróipil)- (9CI, ACI )
| Príomh-Airíonna Fisiceacha | Luach | Coinníoll |
| Meáchan Móilíneach | 769.96 | - |
| Dlús (Tuartha) | 1.25±0.1 g/cm3 | Teocht: 20 °C; Brúigh: 760 Torr |
| pKa (Tuartha) | 9.16±0.20 | Teocht is Airde: 25 °C |
Canonical SMILES O=C1N=C(NC(=O)C(C)C)NC2=C1N=CN2C3OC(COC(C=4C=CC=CC4)(C5=CC=C(OC)C=C5)C6= CC=C(OC)C=C6)C(O)C3O[Si](C)(C)C(C)(C)C
SMILES Isiméireacha
C(OC[C@H]1O[C@H]([C@H](O[Si](C(C)(C)C)(C)C)[C@@H]1O)N2C3= C(N=C2)C( =O)N=C(NC(C(C)C)=O)N3)(C4=CC=C(OC)C=C4)(C5=CC=C(OC)C=C5)C6=CC= CC=C6
InchI
InChI=1S/C41H51N5O8Si/c1-25(2)36(48)44-39-43-35-32(37(49)45-39 )42-24-46(35)38-34(54-55(8,9)40(3,4)5)33(47)31(53-38)23-52-41(2 6-13-11-10-12-14-26,27-15-19-29(50-6)20-16-27)28-17-21-30(51-7 )22-18-28/h10-22,24-25,31,33-34,38,47H,23H2,1-9H3,(H2,43,44,45,
48,49)/t31-,33-,34-,38-/m1/s1
Eochair InChI
JMCNKJFOIJGYRG-CJEGOSRCSA-N
1 Ainm Eile don tSubstaint seo
5′-O-[Bis(4-methocsaifeinil)feanilmeitil]-2′-O-[(1,1-démheitiolaitil)démheitil-sil]-N-(2-meitil-1-ocsaeapróipil)guanóisín (ACI)
Spectra ar fáil
1H NMR
13C NMR
Aifreann
| Airíonna ar fáil |
| Bitheolaíoch |
| Ceimiceach |
| Dlús |
| Lipinski |
| Struchtúr Gaolmhar |
Bitheolaíoch
| Maoin | Luach | Coinníoll | Foinse |
| Fachtóir Bithtiúchana | 1.38×105 | pH 1; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 3.53 x 105 | pH 2; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 4.18×105 | pH 3; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 4.26×105 | pH 4; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 4.26×105 | pH 5; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 4.26×105 | pH 6; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 4.21 x 105 | pH 7; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 3.77×105 | pH 8; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 1.86×105 | pH 9; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 33800 | pH 10; Teocht: 25 °C | (1) ACD |
(1) Arna ríomh ag baint úsáide as Bogearraí Ardfhorbartha Ceimice (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Ceimiceach
| Maoin | Luach | Coinníoll | Foinse |
| Koc | 1.21 x 105 | pH 1; Teocht: 25 °C | (1) ACD |
| Koc | 3.08×105 | pH 2; Teocht: 25 °C | (1) ACD |
| Koc | 3.65×105 | pH 3; Teocht: 25 °C | (1) ACD |
| Koc | 3.72×105 | pH 4; Teocht: 25 °C | (1) ACD |
| Koc | 3.73×105 | pH 5; Teocht: 25 °C | (1) ACD |
| Koc | 3.72×105 | pH 6; Teocht: 25 °C | (1) ACD |
| Koc | 3.68×105 | pH 7; Teocht: 25 °C | (1) ACD |
| Maoin | Luach | Coinníoll | Foinse |
| Koc | 3.30×105 | pH 8; Teocht: 25 °C | (1) ACD |
| Koc | 1.62×105 | pH 9; Teocht: 25 °C | (1) ACD |
| Koc | 29600 | pH 10; Teocht: 25 °C | (1) ACD |
| logD | 7.22 | pH 1; Teocht: 25 °C | (1) ACD |
| logD | 7.63 | pH 2; Teocht: 25 °C | (1) ACD |
| logD | 7.70 | pH 3; Teocht: 25 °C | (1) ACD |
| logD | 7.71 | pH 4; Teocht: 25 °C | (1) ACD |
| logD | 7.71 | pH 5; Teocht: 25 °C | (1) ACD |
| logD | 7.71 | pH 6; Teocht: 25 °C | (1) ACD |
| logD | 7.70 | pH 7; Teocht: 25 °C | (1) ACD |
| logD | 7.66 | pH 8; Teocht: 25 °C | (1) ACD |
| logD | 7.35 | pH 9; Teocht: 25 °C | (1) ACD |
| logD | 6.61 | pH 10; Teocht: 25 °C | (1) ACD |
| logP | 7.710±0.709 | Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Intreach Aifrinn | 2.7 x 10-5 g/L | Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 8.5 x 10-5 g/L | pH 1; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 3.3 x 10-5 g/L | pH 2; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 2.8 x 10-5 g/L | pH 3; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 2.7 x 10-5 g/L | pH 4; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 2.7 x 10-5 g/L | pH 5; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 2.7 x 10-5 g/L | pH 6; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 2.8 x 10-5 g/L | pH 7; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 3.1 x 10-5 g/L | pH 8; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 6.2 x 10-5 g/L | pH 9; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 3.5 x 10-4 g/L | pH 10; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 2.8 x 10-5 g/L | Uisce Neamh-mhaolaithe pH 7.00; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Intreach Molar | 3.5 x 10-8 mol/L | Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 1.1 x 10-7 mol/L | pH 1; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 4.3 x 10-8 mol/L | pH 2; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 3.6 x 10-8 mol/L | pH 3; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 3.5 x 10-8 mol/L | pH 4; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 3.5 x 10-8 mol/L | pH 5; Teocht: 25 °C | (1) ACD |
| Maoin | Luach | Coinníoll | Foinse |
| Tuaslagthacht Molar | 3.5 x 10-8 mol/L | pH 6; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 3.6 x 10-8 mol/L | pH 7; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 4.0 x 10-8 mol/L | pH 8; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 8.1 x 10-8 mol/L | pH 9; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 4.5 x 10-7 mol/L | pH 10; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 3.6 x 10-8 mol/L | Uisce Neamh-mhaolaithe pH 7.00; Teocht: 25 °C | (1) ACD |
| Meáchan Móilíneach | 769.96 | ||
| pKa | 9.16±0.20 | Teocht is Airde: 25 °C | (1) ACD |
| pKa | 1.73±0.10 | Teocht is Bunúsaí: 25 °C | (1) ACD |
(1) Arna ríomh ag baint úsáide as Bogearraí Ardfhorbartha Ceimice (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Dlús
| Maoin | Luach | Coinníoll | Foinse |
| Dlús | 1.25±0.1 g/cm3 | Teocht: 20 °C; Brúigh: 760 Torr | (1) ACD |
| Toirt Molar | 615.5±7.0 cm3/mól | Teocht: 20 °C; Brúigh: 760 Torr | (1) ACD |
(1) Arna ríomh ag baint úsáide as Bogearraí Ardfhorbartha Ceimice (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Maoin | Luach | Coinníoll | Foinse |
| Bannaí Rothlach Saor in Aisce | 14 | (1) ACD | |
| H Glacadóirí | 13 | (1) ACD | |
| H Deontóirí | 3 | (1) ACD | |
| H Suim Deontóra/Ghlacadóir | 16 | (1) ACD | |
| logP | 7.710±0.709 | Teocht: 25 °C | (1) ACD |
| Meáchan Móilíneach | 769.96 |
(1) Arna ríomh ag baint úsáide as Bogearraí Ardfhorbartha Ceimice (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Struchtúr Gaolmhar
| Maoin | Luach | Coinníoll | Foinse |
| Achar Dromchla Polar | 155 A2 | (1) ACD | |
(1) Arna ríomh ag baint úsáide as Bogearraí Ardfhorbartha Ceimice (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Spectra ar fáil
1H NMR
13C NMR
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