![C47H60N7O10P Guanosine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2- methoxyethyl)-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N ,N-bis (1-methylethyl)phosphoramidite] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C47H60N7O10P Guanosine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2- methoxyethyl)-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N ,N-bis (1-methylethyl)phosphoramidite] (ACI) Featured Image](https://cdn.globalso.com/nvchem/C47H60N7O10P-Guanosine.png)
C47H60N7O10P Guanosine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2- methoxyethyl)-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N ,N-bis (1-methylethyl)phosphoramidite] (ACI)
Numero sa Rehistro sa CAS
251647-55-9
H302
| Pangunang Pisikal nga mga Kinaiya | Bili | kahimtang |
| Molekular nga Timbang | 914.00 | - |
| pKa (Gitagna) | 9.16±0.20 | Labing Acid nga Temp: 25 °C |
Canonical SMILES
N#CCCOP(OC1C(OC(N2C= NC=3C(=O)N=C(NC(=O)C(C)C)NC32)C1OCCOC)COC(C=4C=CC=CC4)(C5=CC =C(OC)C=C5)C6=CC=C(OC)C=C6) N(C(C)C)C(C)C
Isomeric SMILES
C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](OCCOC)[C@@ H](O1)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/C47H60N7O10P/c1-30(2)43(55)51-46-50-42-39(44(56)52-46)49-29-53(42)45-41(60-27- 26-57-7)40(64-65(62-25-13-24-48)54( 31(3)4)32(5)6)38(63-45)28-61-47(33- 14-11-10-12-15-33,34-16-20-36(58-8)21-17-34)35-18-22-37(59-9)23-19-35/h10- 12,14-23,29-32,38 ,40-41,45H,13,25-28H2,1-9H3,(H2,50,51,52,55,56)/t38-,40-,41- ,45-,65?/m1/s1
Yawe sa InChI
LADCDGNEBIQAAU-SBCRAQIVSA-N
17 Ubang Ngalan alang niini nga Substansya
Guanosine, 5′-O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-(2-methoxyethyl)-N-(2-methyl-1-oxopropyl)-, 3′ - [2-cyanoethyl bis(1- methylethyl)phosphoramidi] (9CI); 17: PN: US20030212017 PAGE: 20 giangkon nga han-ay; 18: PN: US20030211606 PANID: 20
giangkon nga han-ay; 19: PN: US20040005569 PANID: 22 giangkon nga han-ay; 21: PN: US20040006030 PAGE: 23 giangkon nga han-ay; 21: PN: US20040014047 PANID: 21 giangkon nga han-ay; 21: PN: US20040014049 PANID: 21 giangkon nga han-ay; 22: PN: US20030198965 PAG
E: 20 giangkon nga han-ay; 22: PN: US20040005570 PAGE: 21 giangkon nga han-ay; 22: PN: US20040014048 PAGE: 21 giangkon nga han-ay;
22: PN: US20040014050 PAGE: 21 giangkon nga han-ay; 23: PN: US20040005565 PAGE: 17- 22 giangkon nga han-ay; 23: PN: US20040
014051 PANID: 23 giangkon nga han-ay; 24: PN: US20040014699 PANID: 21 giangkon nga han-ay; 25: PN: US20040006029 PANID: 23 giangkon nga han-ay; 25: PN: WO03106645 PANID: 73 giangkon nga han-ay; 96: PN: US20040005707 PAGE: 21 giangkon nga han-ay
Magamit ang spectra
13 C NMR
Hetero NMR
Mga kabtangan nga magamit
Biyolohikal
Kemikal
Lipinski
May Kalabutan sa Istruktura
| Property | Bili | kahimtang | Tinubdan |
| Bioconcentration Factor | 121 | pH 1; Temperatura: 25 °C | (1) ACD |
| Bioconcentration Factor | 2580 | pH 2; Temperatura: 25 °C | (1) ACD |
| Bioconcentration Factor | 23500 | pH 3; Temperatura: 25 °C | (1) ACD |
| Bioconcentration Factor | 71800 | pH 4; Temperatura: 25 °C | (1) ACD |
| Bioconcentration Factor | 89800 | pH 5; Temperatura: 25 °C | (1) ACD |
| Bioconcentration Factor | 92100 | pH 6; Temperatura: 25 °C | (1) ACD |
| Bioconcentration Factor | 91300 | pH 7; Temperatura: 25 °C | (1) ACD |
| Bioconcentration Factor | 82500 | pH 8; Temperatura: 25 °C | (1) ACD |
| Bioconcentration Factor | 42200 | pH 9; Temperatura: 25 °C | (1) ACD |
| Bioconcentration Factor | 7860 | pH 10; Temperatura: 25 °C | (1) ACD |
(1) Kalkulado gamit ang Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Property | Bili | kahimtang | Tinubdan |
| Si Koc | 164 | pH 1; Temperatura: 25 °C | (1) ACD |
| Si Koc | 3480 | pH 2; Temperatura: 25 °C | (1) ACD |
| Si Koc | 31700 | pH 3; Temperatura: 25 °C | (1) ACD |
| Si Koc | 96900 | pH 4; Temperatura: 25 °C | (1) ACD |
| Si Koc | 1.21 x 105 | pH 5; Temperatura: 25 °C | (1) ACD |
| Property | Bili | kahimtang | Tinubdan |
| Si Koc | 1.24 x 105 | pH 6; Temperatura: 25 °C | (1) ACD |
| Si Koc | 1.23 x 105 | pH 7; Temperatura: 25 °C | (1) ACD |
| Si Koc | 1.11 x 105 | pH 8; Temperatura: 25 °C | (1) ACD |
| Si Koc | 56900 | pH 9; Temperatura: 25 °C | (1) ACD |
| Si Koc | 10600 | pH 10; Temperatura: 25 °C | (1) ACD |
| logD | 3.95 | pH 1; Temperatura: 25 °C | (1) ACD |
| logD | 5.28 | pH 2; Temperatura: 25 °C | (1) ACD |
| logD | 6.24 | pH 3; Temperatura: 25 °C | (1) ACD |
| logD | 6.73 | pH 4; Temperatura: 25 °C | (1) ACD |
| logD | 6.82 | pH 5; Temperatura: 25 °C | (1) ACD |
| logD | 6.83 | pH 6; Temperatura: 25 °C | (1) ACD |
| logD | 6.83 | pH 7; Temperatura: 25 °C | (1) ACD |
| logD | 6.79 | pH 8; Temperatura: 25 °C | (1) ACD |
| logD | 6.50 | pH 9; Temperatura: 25 °C | (1) ACD |
| logD | 5.77 | pH 10; Temperatura: 25 °C | (1) ACD |
| logP | 6.837±0.764 | Temperatura: 25 °C | (1) ACD |
| Mass Intrinsic Solubility | 4.4 x 10-4 g/L | Temperatura: 25 °C | (1) ACD |
| Mass Solubility | 0.34 g/L | pH 1; Temperatura: 25 °C | (1) ACD |
| Mass Solubility | 0.016 g/L | pH 2; Temperatura: 25 °C | (1) ACD |
| Mass Solubility | 1.7 x 10-3 g/L | pH 3; Temperatura: 25 °C | (1) ACD |
| Mass Solubility | 5.7 x 10-4 g/L | pH 4; Temperatura: 25 °C | (1) ACD |
| Mass Solubility | 4.6 x 10-4 g/L | pH 5; Temperatura: 25 °C | (1) ACD |
| Mass Solubility | 4.4 x 10-4 g/L | pH 6; Temperatura: 25 °C | (1) ACD |
| Mass Solubility | 4.5 x 10-4 g/L | pH 7; Temperatura: 25 °C | (1) ACD |
| Mass Solubility | 4.9 x 10-4 g/L | pH 8; Temperatura: 25 °C | (1) ACD |
| Mass Solubility | 1.0 x 10-3 g/L | pH 9; Temperatura: 25 °C | (1) ACD |
| Mass Solubility | 5.2 x 10-3 g/L | pH 10; Temperatura: 25 °C | (1) ACD |
| Mass Solubility | 4.5 x 10-4 g/L | Walay Buffered nga Tubig pH 6.99; Temperatura: 25 °C | (1) ACD |
| Molar Intrinsic Solubility | 4.8 x 10-7 mol/L | Temperatura: 25 °C | (1) ACD |
| Pagkamatunaw sa Molar | 3.7 x 10-4 mol/L | pH 1; Temperatura: 25 °C | (1) ACD |
| Pagkamatunaw sa Molar | 1.7 x 10-5 mol/L | pH 2; Temperatura: 25 °C | (1) ACD |
| Pagkamatunaw sa Molar | 1.9 x 10-6 mol/L | pH 3; Temperatura: 25 °C | (1) ACD |
| Property | Bili | kahimtang | Tinubdan |
| Pagkamatunaw sa Molar | 6.2 x 10-7 mol/L | pH 4; Temperatura: 25 °C | (1) ACD |
| Pagkamatunaw sa Molar | 5.0 x 10-7 mol/L | pH 5; Temperatura: 25 °C | (1) ACD |
| Pagkamatunaw sa Molar | 4.8 x 10-7 mol/L | pH 6; Temperatura: 25 °C | (1) ACD |
| Pagkamatunaw sa Molar | 4.9 x 10-7 mol/L | pH 7; Temperatura: 25 °C | (1) ACD |
| Pagkamatunaw sa Molar | 5.4 x 10-7 mol/L | pH 8; Temperatura: 25 °C | (1) ACD |
| Pagkamatunaw sa Molar | 1.1 x 10-6 mol/L | pH 9; Temperatura: 25 °C | (1) ACD |
| Pagkamatunaw sa Molar | 5.7 x 10-6 mol/L | pH 10; Temperatura: 25 °C | (1) ACD |
| Pagkamatunaw sa Molar | 4.9 x 10-7 mol/L | Walay Buffered nga Tubig pH 6.99; Temperatura: 25 °C | (1) ACD |
| Molekular nga Timbang | 914.00 | ||
| pKa | 9.16±0.20 | Labing Acid nga Temp: 25 °C | (1) ACD |
| pKa | 3.45±0.70 | Labing sukaranan nga Temp: 25 °C | (1) ACD |
(1) Kalkulado gamit ang Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Property | Bili | kahimtang | Tinubdan |
| Libre nga Rotatable Bonds | 22 | (1) ACD | |
| H Mga tigdawat | 17 | (1) ACD | |
| H Mga Donor | 2 | (1) ACD | |
| H Donor/Acceptor Sum | 19 | (1) ACD | |
| logP | 6.837±0.764 | Temperatura: 25 °C | (1) ACD |
| Molekular nga Timbang | 914.00 |
(1) Kalkulado gamit ang Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Property | Bili | Tinubdan sa Kondisyon |
| Polar Surface Area | 203 A2 | (1) ACD |
(1) Kalkulado gamit ang Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Magamit ang spectra
1 H NMR
13 C NMR
| Tinubdan sa Pamahayag sa Hazard sa Code | |
| H302 Makadaot kon lamyon | Klasipikasyon ug Pag-label sa European Chemical Agency (ECHA). Imbentaryo - Gipahibalo nga klasipikasyon ug pag-label - labing kasagaran nga mga pahibalo, European Chemical Agency (ECHA) Klasipikasyon ug Imbentaryo sa Pag-label - Gipahibalo nga klasipikasyon ug pag-label - labing seryoso nga mga pahibalo |
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