C34H39N3O8 Cytidine, 5′-O-[bis (4-methoxyphenyl) phenylmethyl] -2'-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-oth.
Príomh -airíonna fisiceacha | Luach | Coinníollacha a chur le |
Meáchan móilíneach | 617.69 | - |
Fiuchphointe (tuartha) | 762.6 ± 70.0 ° C. | Brúigh: 760 Torr |
Dlús (tuartha) | 1.27 ± 0.1 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr |
PKA (tuartha) | 13.31 ± 0.70 | An luas is aigéid: 25 ° C. |
Smiles Canónach O = C1N = C (N) C (= CN1C2OC (COC (C = 3C = CC = CC3) (C4 = CC = C (OC) C = C4) C5 = CC = C (OC) C = C5) C (O) C2OCCOC) C
Smiles isiméireacha C (OC [C@H] 1o [C@H] ([C@h] (occoc) [c @@ h] 1o) n2c (= o) n = c (n) c (c) = c2) (c3 = cc = c (oc) c = c3) (c4 = cc = c (oc) c = c4) c5 = cc = c = c = c5 = c5 = c5 = c5 = c5 = c5 = c (oc) c (c4) c = cc = cc = cc = cc = cc = c (oc) c (c4) c (c4) c (c4) c = c = cc = cc = cc = cc = c (oc) c (c4) c (c4) c (c4) c (c4) c = c = cc = c.
Orlach
Inchi = 1S/C34H39N3O8/C1-22-20-37 (33 (39) 36-31 (22) 35) 32-30 (43-19-18-40-2) 29 (38) 28 (45-32) 21-44-34 (23-8-6-5-5-5-5-9-23,24-14-26 (4-8-8-6-6-5-5-9-23,24-10-14-14-14-14-14-14-14-14 ( 1-3) 15-11-24) 25-12-16-27 (42-4) 17-13-25/H5-17,20,28-30,32,38H, 18-19,21H2,1-4H3, (H2,35,36,39)/T28-, 29-, 30-, 32-/M1/S1)/T28-, 29-, 30-, 32-/M1/S1
Eochair Inchi
Lyktvjxzqtnpk-pbamlimusa-n
24 ainmneacha eile don tsubstaint seo
5′-O-[bis (4-methoxyphenyl) phenylmethyl] -2′-o- (2-methoxyethyl) -5-methylcytidine (ACI); 11: PN: US20030170636 Leathanach: 17 a éilítear RNA; 12: PN: US20030211606 Leathanach: 18 éileamh r NA; 12: PN: US20030212017 Leathanach: 19 éileamh r NA; 14: PN: US20040005569 PAG E: 21 D'éiligh R NA; 15: PN: US20040005565 Leathanach: 17-22 22 RNA Éilithe; 15: PN: US20040005570 Leathanach: 19 éileamh r NA; 15: PN: U S20040006030 Leathanach: 22 éileamh r NA; 15: PN: US20040014048 Leathanach: 19 éileamh r NA; 16: PN: US20030171313 Leathanach: 9 a éilítear RNA; 16: PN: US20030198965 Leathanach: 19 éileamh r NA; 16: PN: US20040014047 Leathanach: 19 éileamh r NA; 16: PN: US20040014049 Leathanach:
19 éileamh RNA; 17: PN: US20040014051 Leathanach: 21 a éilíodh r NA; 17: PN: US20040014699 Leathanach: 19 éileamh r NA; 17: PN: W
O03106645 Leathanach: 69 éileamh r NA; 18: PN: US20040006029 Leathanach: 22 éileamh r NA; 2′-O-methoxyethyl-5′-O-DimethoxytrityL-5- methylcytidine; 58: PN: US20030166592 Leathanach: 15 Éilithe r NA; 5: PN: WO2005006958 Leathanach: 61 éileamh r NA; 7: PN: WO20050 07825 Leathanach: 61 éileamh r na; 82: PN: US20040171566 LEATHANACH: 18 a éilíodh r NA; 89: PN: US20040005707 Leathanach: 19 éileamh r NA; 9: PN: WO03084478 LEATHANACH: 56 éileamh r na
Airíonna atá ar fáil |
Bitheolaíoch |
Ceimiceán |
Dlús |
Lipinski |
A bhaineann le struchtúr |
Teirmeach |
Bitheolaíoch
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Fachtóir bith -chomhchruinnithe | 1.56 | pH 1; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 1.99 | pH 2; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 6.19 | pH 3; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 38.0 | pH 4; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 116 | pH 5; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 146 | pH 6; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 150 | pH 7; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 151 | pH 8; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 151 | pH 9; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 151 | pH 10; TEMP: 25 ° C. | (1) ACD |
.
Ceimiceán
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
KOC | 13.0 | pH 1; TEMP: 25 ° C. | (1) ACD |
KOC | 16.6 | pH 2; TEMP: 25 ° C. | (1) ACD |
KOC | 51.8 | pH 3; TEMP: 25 ° C. | (1) ACD |
KOC | 318 | pH 4; TEMP: 25 ° C. | (1) ACD |
KOC | 966 | pH 5; TEMP: 25 ° C. | (1) ACD |
KOC | 1220 | pH 6; TEMP: 25 ° C. | (1) ACD |
KOC | 1260 | pH 7; TEMP: 25 ° C. | (1) ACD |
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
KOC | 1260 | pH 8; TEMP: 25 ° C. | (1) ACD |
KOC | 1260 | pH 9; TEMP: 25 ° C. | (1) ACD |
KOC | 1260 | pH 10; TEMP: 25 ° C. | (1) ACD |
logáil | 1.18 | pH 1; TEMP: 25 ° C. | (1) ACD |
logáil | 1.29 | pH 2; TEMP: 25 ° C. | (1) ACD |
logáil | 1.78 | pH 3; TEMP: 25 ° C. | (1) ACD |
logáil | 2.57 | pH 4; TEMP: 25 ° C. | (1) ACD |
logáil | 3.05 | pH 5; TEMP: 25 ° C. | (1) ACD |
logáil | 3.16 | pH 6; TEMP: 25 ° C. | (1) ACD |
logáil | 3.17 | pH 7; TEMP: 25 ° C. | (1) ACD |
logáil | 3.17 | pH 8; TEMP: 25 ° C. | (1) ACD |
logáil | 3.17 | pH 9; TEMP: 25 ° C. | (1) ACD |
logáil | 3.17 | pH 10; TEMP: 25 ° C. | (1) ACD |
logáil | 3.169 ± 0.598 | TEMP: 25 ° C. | (1) ACD |
Aifreann Intreach intreach | 5.2 x 10-3 g/l | TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.51 g/L. | pH 1; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.40 g/L. | pH 2; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.13 g/L. | pH 3; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.020 g/L. | pH 4; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 6.8 x 10-3 g/l | pH 5; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.4 x 10-3 g/l | pH 6; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.3 x 10-3 g/l | pH 7; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.2 x 10-3 g/l | pH 8; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.2 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 | 5.3 x 10-3 g/l | Uisce neamh -mhaolaithe pH 7.05; TEMP: 25 ° C. | (1) ACD |
Intuaslagthacht intreach molar | 8.4 x 10-6 mol/l | TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 8.2 x 10-4 mol/l | pH 1; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 6.4 x 10-4 mol/l | pH 2; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 2.1 x 10-4 mol/l | pH 3; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 3.3 x 10-5 mol/l | pH 4; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 1.1 x 10-5 mol/l | pH 5; TEMP: 25 ° C. | (1) ACD |
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Tuaslagthacht molar | 8.7 x 10-6 mol/l | pH 6; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 8.5 x 10-6 mol/l | pH 7; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 8.4 x 10-6 mol/l | pH 8; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 8.4 x 10-6 mol/l | pH 9; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 8.4 x 10-6 mol/l | pH 10; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 8.5 x 10-6 mol/l | Uisce neamh -mhaolaithe pH 7.05; TEMP: 25 ° C. | (1) ACD |
Meáchan móilíneach | 617.69 | ||
pka | 13.31 ± 0.70 | An luas is aigéid: 25 ° C. | (1) ACD |
pka | 4.58 ± 0.10 | An luas is bunúsaí: 25 ° C. | (1) ACD |
Brú gaile | 1.89 x 10-24 Torr | TEMP: 25 ° C. | (1) ACD |
.
Dlús
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Dlús | 1.27 ± 0.1 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
Toirt molar | 483.8 ± 7.0 cm3/mol | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
.
Lipinski
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Bannaí rotatable faoi shaoirse | 14 | (1) ACD | |
H Glacadóirí | 11 | (1) ACD | |
Hontóirí H. | 3 | (1) ACD | |
H suim deontóra/glacadóir | 14 | (1) ACD | |
logáil | 3.169 ± 0.598 | TEMP: 25 ° C. | (1) ACD |
Meáchan móilíneach | 617.69 |
.
A bhaineann le struchtúr
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Achar dromchla polar | 134 A2 | (1) ACD |
.
Teirmeach
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Fiuchphointe | 762.6 ± 70.0 ° C. | Brúigh: 760 Torr | (1) ACD |
Eantalpacht an ghalraithe | 116.53 ± 3.0 kJ/mol | Brúigh: 760 Torr | (1) ACD |
Bonnphointe | 415.0 ± 35.7 ° C. | (1) ACD |
.
Speictrim ar fáil
1H NMR
13c NMR