![C43H55N4O10P Uridine, 5′ -O- [bis(4-metoxyphenyl)phenylmethyl]-2′ -O-(2-methox yethyl)- 5-methyl-, 3′ – [2-cyanoethyl N,N-bis(1- metiletil)fosfor amida] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C43H55N4O10P Uridine, 5′ -O- [bis(4-metoxyphenyl)phenylmethyl]-2′ -O-(2-methox yethyl)- 5-methyl-, 3′ – [2-cyanoethyl N,N-bis(1- methylethyl)phosphor amidite] (ACI) Gambar Unggulan](https://www.csnvchem.com/uploads/C43H55N4O10P-Uridine.png)
C43H55N4O10P Uridine, 5′ -O- [bis(4-metoxyphenyl)phenylmethyl]-2′ -O-(2-methox yethyl)- 5-methyl-, 3′ – [2-cyanoethyl N,N-bis(1- metiletil)fosfor amida] (ACI)
Nomer Registry CAS
163878-63-5
H302
| Properti Fisik Kunci | Nilai | kahanan |
| Bobot Molekul | 818.89 | - |
| pKa (Prediksi) | 9,55±0,10 | Suhu Paling Asam: 25 °C |
SMILES kanonik
N#CCCOP(OC1C(OC(N2C=C(C(=O)NC2=O)C)C1OCCOC)COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5= CC=C(OC)C=C5)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](OCCOC)[C@@ H](O1)N2C(=O)NC(=O)C(C)=C2)(C3=CC=C(OC)C=C3)(C4=CC =C(OC)C=C4)C5= CC=CC=C5
IngChI
InChI= 1S/C43H55N4O10P/c1-29(2)47(30(3)4)58(55-24-12-23-44)57-38-37(56-41(39(38)53-26- 25-50-6)46-27-31(5)40(48)45-42(46)49)2 8-54-43(32-13-10-9-11-14-32,33-15) -19-35(51-7)20-16-33)34-17-21-36(52-8)22-18-34/h9-11,13-22,27,29-30,37-39 ,41H,12,24-26,28H2, 1-8H3,(H,45,48,49)/t37-,38-,39-,41-,58?/m1/s1
Kunci Inchi
YFRRKZDUDXHJNC-KZQAAKLLSA-N
17 Jeneng Liyane kanggo Zat iki
Uridine, 5'-O- [bis(4-metoksifenil)fenilmetil]-2′-O-(2-methoxyethyl)- 5-methyl-, 3′ - [2-cyanoethylbis(1-methylethyl)phosphor
amida] (9CI);10: PN: US20030212017 PAGE: 18 ngaku RNA;11: PN: US20030211606 PAGE: 18 ngaku RNA;13: PN: US20040
005569 PAGE: 21 ngaku RNA;13: PN: US20040006030 PAGE: 22 ngaku RNA;13: PN: US20040014048 PAGE: 19 ngaku RNA;13: PN: US20040014049 PAGE: 19 ngaku RNA;14: PN: US20030198965 PAGE: 19 ngaku RNA;14: PN: US20040005565 PAGE: 17- 22 ngaku RNA;14: PN: US20040005570 PAGE: 19 ngaku RNA;14: PN: US20040014047 PAGE: 19 ngaku RNA;14: PN: US20040
014699 PAGE: 19 ngaku RNA;15: PN: US20040014050 PAGE: 19 ngaku RNA;15: PN: US20040014051 PAGE: 21 ngaku RNA;15:
PN: WO03106645 PAGE: 69 ngaku RNA;16: PN: US20040006029 PAGE: 22 ngaku RNA;87: PN: US20040005707 PAGE: 19 diklaim RNA
Spectra kasedhiya
1 H NMR
13 C NMR
Hetero NMR
Properti kasedhiya
biologi
Kimia
Lipinski
Struktur Gegandhengan
| Properti | Nilai | kahanan | Sumber |
| Faktor biokonsentrasi | 348 | pH 1;Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 2810 | pH 2;Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 21100 | pH 3;Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 63100 | pH 4;Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 78800 | pH 5;Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 80800 | pH 6;Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 80800 | pH 7;Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 78800 | pH 8;Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 63400 | pH 9;Suhu: 25 °C | (1) ACD |
| Faktor biokonsentrasi | 21800 | 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 | 487 | pH 1;Suhu: 25 °C | (1) ACD |
| Koc | 3940 | pH 2;Suhu: 25 °C | (1) ACD |
| Koc | 29600 | pH 3;Suhu: 25 °C | (1) ACD |
| Koc | 88400 | pH 4;Suhu: 25 °C | (1) ACD |
| Properti | Nilai | kahanan | Sumber |
| Koc | 1.10 x 105 | pH 5;Suhu: 25 °C | (1) ACD |
| Koc | 1,13 x 105 | pH 6;Suhu: 25 °C | (1) ACD |
| Koc | 1,13 x 105 | pH 7;Suhu: 25 °C | (1) ACD |
| Koc | 1.10 x 105 | pH 8;Suhu: 25 °C | (1) ACD |
| Koc | 88800 | pH 9;Suhu: 25 °C | (1) ACD |
| Koc | 30600 | pH 10;Suhu: 25 °C | (1) ACD |
| logD | 4.39 | pH 1;Suhu: 25 °C | (1) ACD |
| logD | 5.30 | pH 2;Suhu: 25 °C | (1) ACD |
| logD | 6.18 | pH 3;Suhu: 25 °C | (1) ACD |
| logD | 6.65 | pH 4;Suhu: 25 °C | (1) ACD |
| logD | 6.75 | pH 5;Suhu: 25 °C | (1) ACD |
| logD | 6.76 | pH 6;Suhu: 25 °C | (1) ACD |
| logD | 6.76 | pH 7;Suhu: 25 °C | (1) ACD |
| logD | 6.75 | pH 8;Suhu: 25 °C | (1) ACD |
| logD | 6.65 | pH 9;Suhu: 25 °C | (1) ACD |
| logD | 6.19 | pH 10;Suhu: 25 °C | (1) ACD |
| logP | 6,761±0,669 | Suhu: 25 °C | (1) ACD |
| Kelarutan Intrinsik Massa | 2,0 x 10-4 g/L | Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 0,046 g/L | pH 1;Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 5,7 x 10-3 g/L | pH 2;Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 7,6 x 10-4 g/L | pH 3;Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 2,5 x 10-4 g/L | pH 4;Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 2,0 x 10-4 g/L | pH 5;Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 2,0 x 10-4 g/L | pH 6;Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 2,0 x 10-4 g/L | pH 7;Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 2,0 x 10-4 g/L | pH 8;Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 2,5 x 10-4 g/L | pH 9;Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 7,4 x 10-4 g/L | pH 10;Suhu: 25 °C | (1) ACD |
| Kelarutan massa | 2,0 x 10-4 g/L | Banyu Unbuffered pH 7,00;Suhu: 25 °C | (1) ACD |
| Kelarutan Intrinsik Molar | 2,4 x 10-7 mol/L | Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 5,6 x 10-5 mol/L | pH 1;Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 7,0 x 10-6 mol/L | pH 2;Suhu: 25 °C | (1) ACD |
| Properti | Nilai | kahanan | Sumber |
| Kelarutan molar | 9,3 x 10-7 mol/L | pH 3;Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 3,1 x 10-7 mol/L | pH 4;Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 2,5 x 10-7 mol / L | pH 5;Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 2,4 x 10-7 mol/L | pH 6;Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 2,4 x 10-7 mol/L | pH 7;Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 2,5 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 | 9,0 x 10-7 mol/L | pH 10;Suhu: 25 °C | (1) ACD |
| Kelarutan molar | 2,4 x 10-7 mol/L | Banyu Unbuffered pH 7,00;Suhu: 25 °C | (1) ACD |
| Bobot Molekul | 818.89 | ||
| pKa | 9,55±0,10 | 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 | 21 | (1) ACD | |
| H. Akseptor | 14 | (1) ACD | |
| H. Donor | 1 | (1) ACD | |
| H Jumlah Donor / Akseptor | 15 | (1) ACD | |
| logP | 6,761±0,669 | Suhu: 25 °C | (1) ACD |
| Bobot Molekul | 818.89 |
(1) Dietung nggunakake Piranti Lunak Pengembangan Kimia Lanjut (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Properti | Nilai | Sumber Kondisi |
| Area lumahing kutub | 164 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
| Sumber Pernyataan Bahaya Kode | |
| H302 Mbebayani yen ditelan | Klasifikasi & Labeling Badan Kimia Eropa (ECHA). Inventarisasi - Klasifikasi lan label sing dilaporake - kabar sing paling umum, Badan Kimia Eropa (ECHA) Inventarisasi Klasifikasi & Label - Klasifikasi lan label sing dilaporake - kabar sing paling serius |
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