C47H60N7O10P guanosine, 5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -o- (2- methoxyethyl) -N- (2-meitil-1-oxopropyl)-3 ′-[2-cyanoethyl N, n-bis (1-mothylethyl) phosporaramidite] (2-cyanoethyl)] (1-bis (1-moethylethyl)].
Uimhir Chlárlann CAS
251647-55-9
H302
Príomh -airíonna fisiceacha | Luach | Coinníollacha a chur le |
Meáchan móilíneach | 914.00 | - |
PKA (tuartha) | 9.16 ± 0.20 | An luas is aigéid: 25 ° C. |
Smiles Canónach
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
Smiles isiméireach
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) N3) N3) (C4 = c = c = c = c = c = c = c = c ([C) C) C) N3 = c = c ( (OC) C = C4) (C5 = CC = C (OC) C = C5) C6 = CC = CC = C6
Orlach
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?
Eochair Inchi
Ladcdgnebiqaau-sbcraqivsa-n
17 Ainm eile don tsubstaint seo
Guanosine, 5 ′ -O-[bis (4-methoxyphenyl) phenylmethyl] -2 ′-O-(2-methoxyethyl)-N-(2-meitil-1-oxopropyl)-, 3 ′-[2-cyanoethyl bis (1- meitiléalach) phosphoramidite] (9ci); 17: PN: US20030212017 Leathanach: 20 Seicheamh éilithe; 18: PN: US20030211606 Leathanach: 20
seicheamh éilithe; 19: PN: US20040005569 Leathanach: 22 Seicheamh éilithe; 21: PN: US20040006030 Leathanach: 23 Seicheamh éilithe; 21: PN: US20040014047 Leathanach: 21 Seicheamh éilithe; 21: PN: US20040014049 Leathanach: 21 Seicheamh éilithe; 22: PN: US20030198965 PAG
E: 20 Seicheamh éilithe; 22: PN: US20040005570 Leathanach: 21 Seicheamh éilithe; 22: PN: US20040014048 Leathanach: 21 Seicheamh éilithe;
22: PN: US20040014050 Leathanach: 21 Seicheamh éilithe; 23: PN: US20040005565 Leathanach: 17- 22 Seicheamh éilithe; 23: PN: US20040
014051 Leathanach: 23 Seicheamh éilithe; 24: PN: US20040014699 Leathanach: 21 Seicheamh éilithe; 25: PN: US20040006029 Leathanach: 23 Seicheamh éilithe; 25: PN: WO03106645 Leathanach: 73 Seicheamh éilithe; 96: PN: US20040005707 Leathanach: 21 Seicheamh Éilithe
Speictrim ar fáil
13 C NMR
Hetero NMR
Airíonna atá ar fáil
Bitheolaíoch
Ceimiceán
Lipinski
A bhaineann le struchtúr
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Fachtóir bith -chomhchruinnithe | 121 | pH 1; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 2580 | pH 2; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 23500 | pH 3; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 71800 | pH 4; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 89800 | pH 5; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 92100 | pH 6; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 91300 | pH 7; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 82500 | pH 8; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 42200 | pH 9; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 7860 | pH 10; TEMP: 25 ° C. | (1) ACD |
.
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
KOC | 164 | pH 1; TEMP: 25 ° C. | (1) ACD |
KOC | 3480 | pH 2; TEMP: 25 ° C. | (1) ACD |
KOC | 31700 | pH 3; TEMP: 25 ° C. | (1) ACD |
KOC | 96900 | pH 4; TEMP: 25 ° C. | (1) ACD |
KOC | 1.21 x 105 | pH 5; TEMP: 25 ° C. | (1) ACD |
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
KOC | 1.24 x 105 | pH 6; TEMP: 25 ° C. | (1) ACD |
KOC | 1.23 x 105 | pH 7; TEMP: 25 ° C. | (1) ACD |
KOC | 1.11 x 105 | pH 8; TEMP: 25 ° C. | (1) ACD |
KOC | 56900 | pH 9; TEMP: 25 ° C. | (1) ACD |
KOC | 10600 | pH 10; TEMP: 25 ° C. | (1) ACD |
logáil | 3.95 | pH 1; TEMP: 25 ° C. | (1) ACD |
logáil | 5.28 | pH 2; TEMP: 25 ° C. | (1) ACD |
logáil | 6.24 | pH 3; TEMP: 25 ° C. | (1) ACD |
logáil | 6.73 | pH 4; TEMP: 25 ° C. | (1) ACD |
logáil | 6.82 | pH 5; TEMP: 25 ° C. | (1) ACD |
logáil | 6.83 | pH 6; TEMP: 25 ° C. | (1) ACD |
logáil | 6.83 | pH 7; TEMP: 25 ° C. | (1) ACD |
logáil | 6.79 | pH 8; TEMP: 25 ° C. | (1) ACD |
logáil | 6.50 | pH 9; TEMP: 25 ° C. | (1) ACD |
logáil | 5.77 | pH 10; TEMP: 25 ° C. | (1) ACD |
logáil | 6.837 ± 0.764 | TEMP: 25 ° C. | (1) ACD |
Aifreann Intreach intreach | 4.4 x 10-4 g/l | TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.34 g/l | pH 1; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.016 g/L. | pH 2; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 1.7 x 10-3 g/l | pH 3; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.7 x 10-4 g/l | pH 4; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 4.6 x 10-4 g/l | pH 5; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 4.4 x 10-4 g/l | pH 6; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 4.5 x 10-4 g/l | pH 7; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 4.9 x 10-4 g/l | pH 8; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 1.0 x 10-3 g/l | pH 9; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.2 x 10-3 g/l | pH 10; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 4.5 x 10-4 g/l | Uisce neamh -mhaolaithe pH 6.99; TEMP: 25 ° C. | (1) ACD |
Intuaslagthacht intreach molar | 4.8 x 10-7 mol/l | TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 3.7 x 10-4 mol/l | pH 1; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 1.7 x 10-5 mol/l | pH 2; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 1.9 x 10-6 mol/l | pH 3; TEMP: 25 ° C. | (1) ACD |
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Tuaslagthacht molar | 6.2 x 10-7 mol/l | pH 4; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 5.0 x 10-7 mol/l | pH 5; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 4.8 x 10-7 mol/l | pH 6; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 4.9 x 10-7 mol/l | pH 7; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 5.4 x 10-7 mol/l | pH 8; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 1.1 x 10-6 mol/l | pH 9; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 5.7 x 10-6 mol/l | pH 10; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 4.9 x 10-7 mol/l | Uisce neamh -mhaolaithe pH 6.99; TEMP: 25 ° C. | (1) ACD |
Meáchan móilíneach | 914.00 | ||
pka | 9.16 ± 0.20 | An luas is aigéid: 25 ° C. | (1) ACD |
pka | 3.45 ± 0.70 | An luas is bunúsaí: 25 ° C. | (1) ACD |
.
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Bannaí rotatable faoi shaoirse | 22 | (1) ACD | |
H Glacadóirí | 17 | (1) ACD | |
Hontóirí H. | 2 | (1) ACD | |
H suim deontóra/glacadóir | 19 | (1) ACD | |
logáil | 6.837 ± 0.764 | TEMP: 25 ° C. | (1) ACD |
Meáchan móilíneach | 914.00 |
.
Maoin | Luach | Foinse choinníll |
Achar dromchla polar | 203 A2 | (1) ACD |
.
Speictrim ar fáil
1 H NMR
13 C NMR
Foinse Ráiteas Guaise Cód | |
H302 díobhálach má shlogtar é | Aicmiú & Lipéadú na Gníomhaireachta Ceimiceach Eorpach (ECHA) Fardal - Aicmiú agus Lipéadú Fógraithe - Fógraí is Coitianta, Gníomhaireacht Cheimiceach na hEorpa (ECHA) Fardal Aicmithe & Lipéadaithe - Aicmiú agus Lipéadú Fógraithe - Fógraí is tromchúisí |