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)
Nomoro ea Registry ea CAS
251647-55-9
H302
Lintho Tsa Bohlokoa Tsa 'Mele | Boleng | Boemo |
Boima ba Molek'hule | 914.00 | - |
pKa (E boletsoeng esale pele) | 9.16±0.20 | Mocheso o nang le Asiti ka ho Fetisisa: 25 °C |
Canonical POSISO
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 SOSOA
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
Senotlolo sa InChi
LADCDGNEBIQAAU-SBCRAQIVSA-N
17 Mabitso a Mang a Ntho ena
Guanosine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-(2-methoxyethyl)-N-(2-methyl-1-oxopropyl)-, 3′ - [2-cyanoethyl bis(1- methylethyl)phosphoramidite] (9CI); 17: PN: US20030212017 LEQEPHE: 20 tse bakiloeng tatelano; 18: PN: US20030211606 LEQEPHE: 20
tatellano e boletsoeng; 19: PN: US20040005569 LEQEPHE: 22 tse tsekoang tatelano; 21: PN: US20040006030 LEQEPHE: 23 tse batloang tatelano; 21: PN: US20040014047 LEQEPHE: 21 tse boleloang tatelano; 21: PN: US20040014049 LEQEPHE: 21 tse boleloang tatelano; 22: PN: US20030198965 PAG
E: 20 e bolela tatelano; 22: PN: US20040005570 LEQEPHE: 21 tse batloang tatelano; 22: PN: US20040014048 LEQEPHE: 21 tse batloang tatelano;
22: PN: US20040014050 LEQEPHE: 21 tse batloang tatelano; 23: PN: US20040005565 LEQEPHE: 17- 22 tseko tse tatellano; 23: PN: US20040
014051 LEQEPHE: 23 tse boleloang tatelano; 24: PN: US20040014699 LEQEPHE: 21 tse batloang tatelano; 25: PN: US20040006029 LEQEPHE: 23 tse batloang tatelano; 25: PN: WO03106645 LEQEPHE: 73 tatellano e tsekwang; 96: PN: US20040005707 LEQEPHE: 21 tse tsekoang tatelano
Spectra e fumaneha
13 C NMR
Hetero NMR
Thepa e teng
Likokoana-hloko
Lik'hemik'hale
Lipinski
Sebopeho se Amanang
Thepa | Boleng | Boemo | Mohloli |
Bioconcentration Factor | 121 | pH 1; Mocheso: 25 °C | (1) ACD |
Bioconcentration Factor | 2580 | pH 2; Mocheso: 25 °C | (1) ACD |
Bioconcentration Factor | 23500 | pH 3; Mocheso: 25 °C | (1) ACD |
Bioconcentration Factor | 71800 | pH 4; Mocheso: 25 °C | (1) ACD |
Bioconcentration Factor | 89800 | pH 5; Mocheso: 25 °C | (1) ACD |
Bioconcentration Factor | 92100 | pH 6; Mocheso: 25 °C | (1) ACD |
Bioconcentration Factor | 91300 | pH 7; Mocheso: 25 °C | (1) ACD |
Bioconcentration Factor | 82500 | pH 8; Mocheso: 25 °C | (1) ACD |
Bioconcentration Factor | 42200 | pH 9; Mocheso: 25 °C | (1) ACD |
Bioconcentration Factor | 7860 | pH 10; Mocheso: 25 °C | (1) ACD |
(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Thepa | Boleng | Boemo | Mohloli |
Koc | 164 | pH 1; Mocheso: 25 °C | (1) ACD |
Koc | 3480 | pH 2; Mocheso: 25 °C | (1) ACD |
Koc | 31700 | pH 3; Mocheso: 25 °C | (1) ACD |
Koc | 96900 | pH 4; Mocheso: 25 °C | (1) ACD |
Koc | 1.21 x 105 | pH 5; Mocheso: 25 °C | (1) ACD |
Thepa | Boleng | Boemo | Mohloli |
Koc | 1.24 x 105 | pH 6; Mocheso: 25 °C | (1) ACD |
Koc | 1.23 x 105 | pH 7; Mocheso: 25 °C | (1) ACD |
Koc | 1.11 x 105 | pH 8; Mocheso: 25 °C | (1) ACD |
Koc | 56900 | pH 9; Mocheso: 25 °C | (1) ACD |
Koc | 10600 | pH 10; Mocheso: 25 °C | (1) ACD |
logD | 3.95 | pH 1; Mocheso: 25 °C | (1) ACD |
logD | 5.28 | pH 2; Mocheso: 25 °C | (1) ACD |
logD | 6.24 | pH 3; Mocheso: 25 °C | (1) ACD |
logD | 6.73 | pH 4; Mocheso: 25 °C | (1) ACD |
logD | 6.82 | pH 5; Mocheso: 25 °C | (1) ACD |
logD | 6.83 | pH 6; Mocheso: 25 °C | (1) ACD |
logD | 6.83 | pH 7; Mocheso: 25 °C | (1) ACD |
logD | 6.79 | pH 8; Mocheso: 25 °C | (1) ACD |
logD | 6.50 | pH 9; Mocheso: 25 °C | (1) ACD |
logD | 5.77 | pH 10; Mocheso: 25 °C | (1) ACD |
logP | 6.837±0.764 | Mocheso: 25 °C | (1) ACD |
Mass Intrinsic Sollubility | 4.4 x 10-4 g/L | Mocheso: 25 °C | (1) ACD |
Ho qhibiliha ka bongata | 0.34 g/L | pH 1; Mocheso: 25 °C | (1) ACD |
Ho qhibiliha ka bongata | 0.016 g/L | pH 2; Mocheso: 25 °C | (1) ACD |
Ho qhibiliha ka bongata | 1.7 x 10-3 g/L | pH 3; Mocheso: 25 °C | (1) ACD |
Ho qhibiliha ka bongata | 5.7 x 10-4 g/L | pH 4; Mocheso: 25 °C | (1) ACD |
Ho qhibiliha ka bongata | 4.6 x 10-4 g/L | pH 5; Mocheso: 25 °C | (1) ACD |
Ho qhibiliha ka bongata | 4.4 x 10-4 g/L | pH 6; Mocheso: 25 °C | (1) ACD |
Ho qhibiliha ka bongata | 4.5 x 10-4 g/L | pH 7; Mocheso: 25 °C | (1) ACD |
Ho qhibiliha ka bongata | 4.9 x 10-4 g/L | pH 8; Mocheso: 25 °C | (1) ACD |
Ho qhibiliha ka bongata | 1.0 x 10-3 g/L | pH 9; Mocheso: 25 °C | (1) ACD |
Ho qhibiliha ka bongata | 5.2 x 10-3 g/L | pH 10; Mocheso: 25 °C | (1) ACD |
Ho qhibiliha ka bongata | 4.5 x 10-4 g/L | Metsi a sa tsitsang pH 6.99; Mocheso: 25 °C | (1) ACD |
Molar Intrinsic Solubility | 4.8 x 10-7 mol/L | Mocheso: 25 °C | (1) ACD |
Molar Solubility | 3.7 x 10-4 mol/L | pH 1; Mocheso: 25 °C | (1) ACD |
Molar Solubility | 1.7 x 10-5 mol/L | pH 2; Mocheso: 25 °C | (1) ACD |
Molar Solubility | 1.9 x 10-6 mol/L | pH 3; Mocheso: 25 °C | (1) ACD |
Thepa | Boleng | Boemo | Mohloli |
Molar Solubility | 6.2 x 10-7 mol/L | pH 4; Mocheso: 25 °C | (1) ACD |
Molar Solubility | 5.0 x 10-7 mol/L | pH 5; Mocheso: 25 °C | (1) ACD |
Molar Solubility | 4.8 x 10-7 mol/L | pH 6; Mocheso: 25 °C | (1) ACD |
Molar Solubility | 4.9 x 10-7 mol/L | pH 7; Mocheso: 25 °C | (1) ACD |
Molar Solubility | 5.4 x 10-7 mol/L | pH 8; Mocheso: 25 °C | (1) ACD |
Molar Solubility | 1.1 x 10-6 mol/L | pH 9; Mocheso: 25 °C | (1) ACD |
Molar Solubility | 5.7 x 10-6 mol/L | pH 10; Mocheso: 25 °C | (1) ACD |
Molar Solubility | 4.9 x 10-7 mol/L | Metsi a sa tsitsang pH 6.99; Mocheso: 25 °C | (1) ACD |
Boima ba Molek'hule | 914.00 | ||
pKa | 9.16±0.20 | Mocheso o nang le Asiti ka ho Fetisisa: 25 °C | (1) ACD |
pKa | 3.45±0,70 | Mocheso ka ho Fetisisa oa Motheo: 25 °C | (1) ACD |
(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Thepa | Boleng | Boemo | Mohloli |
Li-Bonds tse ka fetolehang ka bolokolohi | 22 | (1) ACD | |
H Ba amohelang | 17 | (1) ACD | |
H Bafani | 2 | (1) ACD | |
H Kakaretso ea Mofani/Moamoheli | 19 | (1) ACD | |
logP | 6.837±0.764 | Mocheso: 25 °C | (1) ACD |
Boima ba Molek'hule | 914.00 |
(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Thepa | Boleng | Mohloli oa Boemo |
Sebaka sa Polar Surface | 203 A2 | (1) ACD |
(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra e fumaneha
1 H NMR
13 C NMR
Mohloli oa Tlaleho ea Kotsi ea Khoutu | |
H302 E kotsi ha e koetsoe | Sehlopha sa European Chemical Agency (ECHA) Classification & Labelling Inventory - Sehlopha se tsebisitsoeng le ho ngolisoa - litsebiso tse tloaelehileng haholo, European Chemical Agency (ECHA) Classification&Labelling Inventory - Sehlopha se tsebisitsoeng le ho ngola - litsebiso tse tebileng haholo |