C41h43n3o9 cytidine, n-Benzoyl-5'-o- [bis (4-methyl- (9ci, aci) h335, h319, h319, h319, h319, h319, h319
Thepa ea bohlokoa ea 'mele | Boleng | Boemo |
Boima ba Molecular | 721.80 | - |
Ntlha ea ho qhibiliha (liteko) | 107-110 ° C | - |
Mabenyane (a boletsoeng esale pele) | 1.26 ± 0.1 g / cm3 | Temp: 20 ° C; Tobetsa: 760 Torr |
pka (e boletsoeng esale pele) | 8.60 ± 0.40 | Boholo ba tempele ea acidic: 25 ° C |
Cannonical Smiles O = C1n = C1 (NC (= O) c1 = cc = C
Isomerica e bososela
C (Oc [c @ h] 1O [C @ h] ([C @ h] (
Inchi
Inchi = 1s / c41h43n3o9 / c1-25-44 (40-39) 26-52 (4,51) 26-52
-9-6-10-14-19,30-19-30-19-30) 22-18-23,393, 3 5- / S1 / S1
Senotlolo sa Inchi
Byscuaikfeah-LZurgkrnsa-n
23 Mabitso a Mang bakeng sa ntho ena
N-benzoyl-5'-o- [-the) [4-Methylmethyl] -2-methylcytine (aci); 10: Pn: Pn: Wo0308444444488 Page: 12: Pn: PN: US20030170636 leqepheng la: 17 e ne e tsejoa RO; 13: Pn: PN: US200302120111111111111111111111111111 14: PN: US20030
211606 LEQEPHEEPHEE: 19 e kopitseng r na; 15: Pn: PN: US200400055569 4: Pn: PN: US2004000606003: 22 e kopantsoeng RO; PN: PN: PN: US200400148 Leqephe: 20 e ba tse reretsoeng RO; 17: Pn: PN: US20030171313: 9 e kopantsoeng r Na; 17: Pn: US200400055565 LEQEPHES: 1767 e tummeng RNA; 17: Pn: US20040005570 leqephe: 20 tse reretsoeng R NA; 17: Pn: US200400140047 LEQEPHEPH447 LEQEPHEPH447 17: Pn: US20040440 014050 614050 18: Pn: PN: US200301965 LEQEPHE: 19 e kopileng r Na; 18: Pn: PN: US200400146996996996996996996996996996996996 19: Pn: US2004000606002999 19: PN: Leqephe la Wo03106645 LEQEPHE: 71 e kopantsoeng RO; 59: Pn: PN: PN2003016666666666 Leqephe la 1 6: PN: Leqephe la Wo2005006958 Leqephe: 83: PN: PN: US20040171566 LEQEPHEEPHEPH7166 LEQEPHE: 18 o ile a re re na; 8: Pn: Wo2005007825
LEQEPHE: 62 e ne e batla RO; 90: Pn: PN: US20040005707 leqepheng la: 20 tse reretsoeng r NA; N4-benzoyl-2'-o-methoyExethyl-5'-o-o-dimethoytherl-5-
Methylcytine
Thepa e fumanehang |
Armal |
Armal
Thepa | Boleng | Boemo | Mohloli |
Ntlha ea ho qhibiliha | 107-110 ° C | (1) cas |
(1) Ponjarla, Srishylam. Li-nucleosides
Spectra e fumanehang
1h nmr
13c nmr
Thepa e fumanehang |
Sa tlhaho |
Lik'hemik'hale |
Letsoalo |
LIPINSSKI |
Sebopeho se amanang le |
Sa tlhaho
Thepa | Boleng | Boemo | Mohloli |
Linkho tsa BioCentration | 291 | ph 1; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 644 | ph 2; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 3690 | ph 3; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 15600 | PH 4; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 23700 | ph 5; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 24800 | PH 6; TEMP: 25 ° C | (1) ACD |
Thepa | Boleng | Boemo | Mohloli |
Linkho tsa BioCentration | 23300 | PH 7; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 14100 | PH 8; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 3010 | ph 9; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 558 | ph 10; TEMP: 25 ° C | (1) ACD |
.
Lik'hemik'hale
Thepa | Boleng | Boemo | Mohloli |
Koc | 569 | ph 1; TEMP: 25 ° C | (1) ACD |
Koc | 1260 | ph 2; TEMP: 25 ° C | (1) ACD |
Koc | 7210 | ph 3; TEMP: 25 ° C | (1) ACD |
Koc | 30400 | PH 4; TEMP: 25 ° C | (1) ACD |
Koc | 46300 | ph 5; TEMP: 25 ° C | (1) ACD |
Koc | 48500 | PH 6; TEMP: 25 ° C | (1) ACD |
Koc | 45500 | PH 7; TEMP: 25 ° C | (1) ACD |
Koc | 27500 | PH 8; TEMP: 25 ° C | (1) ACD |
Koc | 5890 | ph 9; TEMP: 25 ° C | (1) ACD |
Koc | 1090 | ph 10; TEMP: 25 ° C | (1) ACD |
logd | 4.16 | ph 1; TEMP: 25 ° C | (1) ACD |
logd | 4.50 | ph 2; TEMP: 25 ° C | (1) ACD |
logd | 5.26 | ph 3; TEMP: 25 ° C | (1) ACD |
logd | 5.88 | PH 4; TEMP: 25 ° C | (1) ACD |
logd | 6.07 | ph 5; TEMP: 25 ° C | (1) ACD |
logd | 6.09 | PH 6; TEMP: 25 ° C | (1) ACD |
logd | 6.06 | PH 7; TEMP: 25 ° C | (1) ACD |
logd | 5.84 | PH 8; TEMP: 25 ° C | (1) ACD |
logd | 5.17 | ph 9; TEMP: 25 ° C | (1) ACD |
logd | 4.44 | ph 10; TEMP: 25 ° C | (1) ACD |
Logp | 6.093 ± 0.720 | TEMP: 25 ° C | (1) ACD |
Mass Interrincic solubility | 1.3 x 10-4 g / l | TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 0.011 g / l | ph 1; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 5.0 x 10-3 g / l | ph 2; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 8.7 x 10-4 g / l | ph 3; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 2.1 x 10-4 g / l | PH 4; TEMP: 25 ° C | (1) ACD |
Thepa | Boleng | Boemo | Mohloli |
Mass Slisedity | 1.4 x 10-4 g / l | ph 5; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 1.3 x 10-4 g / l | PH 6; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 1.4 x 10-4 g / l | PH 7; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 2.3 x 10-4 g / l | PH 8; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 1.1 x 10-3 g / l | ph 9; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 5.8 x 10-3 g / l | ph 10; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 1.4 x 10-4 g / l | Ph 6 6.97; TEMP: 25 ° C | (1) ACD |
Molala oa Molala oa Molala | 1.8 x 10-7 Mol / L | TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.5 x 10-5 mol / l | ph 1; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.9 x 10-6 mol / L | ph 2; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.2 x 10-6 mol / L | ph 3; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 2.9 x 10-7 Mol / L | PH 4; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.9 x 10-7 Mol / L | ph 5; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.8 x 10-7 Mol / L | PH 6; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.9 x 10-7 Mol / L | PH 7; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 3.2 x 10-7 Mol / L | PH 8; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.5 x 10-6 mol / L | ph 9; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 8.0 x 10-6 mol / L | ph 10; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.9 x 10-7 Mol / L | Ph 6 6.97; TEMP: 25 ° C | (1) ACD |
Boima ba Molecular | 721.80 | ||
pka | 8.60 ± 0.40 | Boholo ba tempele ea acidic: 25 ° C | (1) ACD |
pka | 3.87 ± 0.20 | Boholo ba mosebetsi oa mantlha: 25 ° C | (1) ACD |
.
Letsoalo
Thepa | Boleng | Boemo | Mohloli |
Letsoalo | 1.26 ± 0.1 g / cm3 | Temp: 20 ° C; Tobetsa: 760 Torr | (1) ACD |
Molumo oa Molalar | 572.5 ± 7.0 cm3 / mol | Temp: 20 ° C; Tobetsa: 760 Torr | (1) ACD |
.
LIPINSSKI
Thepa | Boleng | Boemo | Mohloli |
Li-litlama tse potolohileng ka bolokolohi | 15 | (1) ACD |
Thepa | Boleng | Boemo | Mohloli |
H | 12 | (1) ACD | |
H donors | 2 | (1) ACD | |
H donor / Canot | 14 | (1) ACD | |
Logp | 6.093 ± 0.720 | TEMP: 25 ° C | (1) ACD |
Boima ba Molecular | 721.80 |
.
Sebopeho se amanang le
Thepa | Boleng | Boemo | Mohloli |
Sebaka sa polar. | 137 A2 | (1) ACD |
.
Spectra e fumanehang
1h nmr
13c nmr
Khoutu | Polelo ea kotsi | Mohloli |
H335 | E ka baka ho teneha ha phefumoloho | Setsi sa Europe sa Europe ea Europe (ECHA) Sekheo sa Bo-'mè le Labeding le ho ngolisa |
H319 | E baka ho teneha ka thata | Setsi sa Europe sa Europe ea Europe (ECHA) Sekheo sa Bo-'mè le Labeding le ho ngolisa |
H315 | E baka ho teneha ha letlalo | Setsi sa Europe sa Europe ea Europe (ECHA) Sekheo sa Bo-'mè le Labeding le ho ngolisa |