![C45H56N7O9P Guanosine, 5′ -O- [bis(4-metoxyphenyl)phenylmethyl]-2′ -O-methyl- N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N,N-bis (1-metiletil) fosforamidit] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C45H56N7O9P Guanosine, 5′ -O- [bis(4-metoxyphenyl)phenylmethyl]-2′ -O-methyl- N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N,N-bis (1-methylethyl) phosphoramidit] (ACI) Gambar Unggulan](https://www.csnvchem.com/uploads/C45H56N7O9P.png)
C45H56N7O9P Guanosine, 5′ -O- [bis(4-metoxyphenyl)phenylmethyl]-2′ -O-methyl- N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N,N-bis (1-metiletil) fosforamidit] (ACI)
Nomer Registry CAS
150780-67-9
H303
| Properti Fisik Kunci | Nilai | kahanan |
| Bobot Molekul | 869.94 | - |
| pKa (Prediksi) | 9.16±0.20 | Suhu Paling Asam: 25 °C |
N#CCCOP(OC1C(OC(N2C= NC=3C(=O)N=C(NC(=O)C(C)C)NC32)C1OC)COC(C=4C=CC=CC4)(C5=CC =C(OC)C=C5)C6=CC=C(OC)C=C6)N(C(C)C)C(C)C
Isomerik SMILES
C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](OC)[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
IngChI
InChI= 1S/C45H56N7O9P/c1-28(2)41(53)49-44-48-40-37(42(54)50-44)47-27-51(40)43-39(57-9) 38(61-62(59-25-13-24-
46)52(29(3)4)30(5)6)36(60-43)26-58-45(31-14-11-10-12-15-31,32-1 6-20-34(55-7)21-17-32)33-18-22-35(56-8)23-19-33/h10-12,14-23,27 -30,36,38-39,43H,13,25-26H2,1-9H3,(H2,48,49,50,53,54)/t36-,38-,39-,43-,62?/ m1/s1
Kunci Inchi
IRRDHRZUOZNWDJ-MLLDKZSOSA-N
1 Jeneng Liyane kanggo Zat iki
Guanosin, 5'-O- [bis(4-metoksifenil)fenilmetil]-2′-O-metil-N-(2-metil-1-oxopropyl)-, 3′ - [2-cyanoethyl bis(1-methylethyl) phosphoramidite] (9CI)
Spectra kasedhiya
13 C NMR
Hetero NMR
Properti kasedhiya
biologi
Kimia
Lipinski
Struktur Gegandhengan
| Properti | Nilai | kahanan | Sumber |
| Faktor biokonsentrasi | 183 | pH 1; Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 3890 | pH 2; Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 35500 | pH 3; Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 1,08 x 105 | pH 4; Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 1,36 x 105 | pH 5; Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 1,39 x 105 | pH 6; Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 1,38 x 105 | pH 7; Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 1,24 x 105 | pH 8; Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 63600 | pH 9; Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 11900 | pH 10; Suhu: 25 °C | (1) ACD |
(1) Dietung nggunakake Piranti Lunak Pengembangan Kimia Lanjut (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Properti | Nilai | kahanan | Sumber |
| Koc | 220 | pH 1; Suhu: 25 °C | (1) ACD |
| Koc | 4680 | pH 2; Suhu: 25 °C | (1) ACD |
| Koc | 42600 | pH 3; Suhu: 25 °C | (1) ACD |
| Koc | 1,30 x 105 | pH 4; Suhu: 25 °C | (1) ACD |
| Koc | 1,63 x 105 | pH 5; Suhu: 25 °C | (1) ACD |
| Koc | 1,67 x 105 | pH 6; Suhu: 25 °C | (1) ACD |
| Koc | 1,65 x 105 | pH 7; Suhu: 25 °C | (1) ACD |
| Koc | 1,49 x 105 | pH 8; Suhu: 25 °C | (1) ACD |
| Properti | Nilai | kahanan | Sumber |
| Koc | 76400 | pH 9; Suhu: 25 °C | (1) ACD |
| Koc | 14200 | pH 10; Suhu: 25 °C | (1) ACD |
| logD | 4.19 | pH 1; Suhu: 25 °C | (1) ACD |
| logD | 5.52 | pH 2; Suhu: 25 °C | (1) ACD |
| logD | 6.48 | pH 3; Suhu: 25 °C | (1) ACD |
| logD | 6.96 | pH 4; Suhu: 25 °C | (1) ACD |
| logD | 7.06 | pH 5; Suhu: 25 °C | (1) ACD |
| logD | 7.07 | pH 6; Suhu: 25 °C | (1) ACD |
| logD | 7.07 | pH 7; Suhu: 25 °C | (1) ACD |
| logD | 7.02 | pH 8; Suhu: 25 °C | (1) ACD |
| logD | 6.73 | pH 9; Suhu: 25 °C | (1) ACD |
| logD | 6.00 | pH 10; Suhu: 25 °C | (1) ACD |
| logP | 7,072±0,721 | Suhu: 25 °C | (1) ACD |
| Kelarutan Intrinsik Massa | 1,2 x 10-4 g/L | Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 0,096 g/L | pH 1; Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 4,3 x 10-3 g/L | pH 2; Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 4,8 x 10-4 g/L | pH 3; Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 1,6 x 10-4 g/L | pH 4; Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 1,2 x 10-4 g/L | pH 5; Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 1,2 x 10-4 g/L | pH 6; Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 1,2 x 10-4 g/L | pH 7; Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 1,4 x 10-4 g/L | pH 8; Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 2,7 x 10-4 g/L | pH 9; Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 1,4 x 10-3 g/L | pH 10; Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 1,2 x 10-4 g/L | Banyu Unbuffered pH 7,00; Suhu: 25 °C | (1) ACD |
| Kelarutan Intrinsik Molar | 1,4 x 10-7 mol/L | Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 1,1 x 10-4 mol / L | pH 1; Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 5,0 x 10-6 mol/L | pH 2; Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 5,5 x 10-7 mol / L | pH 3; Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 1,8 x 10-7 mol/L | pH 4; Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 1,4 x 10-7 mol/L | pH 5; Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 1,4 x 10-7 mol/L | pH 6; Suhu: 25 °C | (1) ACD |
| Properti | Nilai | kahanan | Sumber |
| Kelarutan molar | 1,4 x 10-7 mol/L | pH 7; Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 1,6 x 10-7 mol/L | pH 8; Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 3,1 x 10-7 mol/L | pH 9; Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 1,6 x 10-6 mol/L | pH 10; Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 1,4 x 10-7 mol/L | Banyu Unbuffered pH 7,00; Suhu: 25 °C | (1) ACD |
| Bobot Molekul | 869.94 | ||
| pKa | 9.16±0.20 | Suhu Paling Asam: 25 °C | (1) ACD |
| pKa | 3.45±0.70 | Suhu Paling Dasar: 25 °C | (1) ACD |
(1) Dietung nggunakake Piranti Lunak Pengembangan Kimia Lanjut (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Properti | Nilai | kahanan | Sumber |
| Obligasi sing bisa diputer kanthi bebas | 19 | (1) ACD | |
| H. Akseptor | 16 | (1) ACD | |
| H. Donor | 2 | (1) ACD | |
| H Jumlah Donor / Akseptor | 18 | (1) ACD | |
| logP | 7,072±0,721 | Suhu: 25 °C | (1) ACD |
| Bobot Molekul | 869.94 |
(1) Dietung nggunakake Piranti Lunak Pengembangan Kimia Lanjut (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Properti | Nilai | Sumber Kondisi |
| Area lumahing kutub | 194 A2 | (1) ACD |
(1) Dietung nggunakake Piranti Lunak Pengembangan Kimia Lanjut (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Spectra kasedhiya
1 H NMR
13 C NMR
| Kode | Pranyatan Bebaya | Sumber |
| H303 | Bisa mbebayani yen ditelan | Expert Curated |
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