![C45H56N7O9P guanosine, 5 ′ -O- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -O-methyl- n- (2-methyl-1-oxopropyl)-, 3 ′-[2-cyanoethyl n, n-bis (1-methylethyl) phosphoramidite] (aci)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C45H56N7O9P guanosine, 5 ′ -O- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -O-methyl- n- (2-methyl-1-oxopropyl)-, 3 ′-[2-cyanoethyl n, n-bis (1-methylethyl) phosphoramidite] (aci)](https://cdn.globalso.com/nvchem/C45H56N7O9P.png)
C45H56N7O9P guanosine, 5 ′ -O- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -O-methyl- n- (2-methyl-1-oxopropyl)-, 3 ′-[2-cyanoethyl n, n-bis (1-methylethyl) phosphoramidite] (aci)
Numero ng rehistro ng CAS
150780-67-9
H303
| Mga pangunahing katangian ng pisikal | Halaga | Kundisyon |
| Molekular na timbang | 869.94 | - |
| pka (hinulaang) | 9.16 ± 0.20 | Karamihan sa acidic temp: 25 ° C. |
N#CCCOP (OC1C (OC (N2C = NC = 3C (= O) N = C (NC (= O) C (C) C) NC32) CC = C (OC) C = C5) C6 = CC = C (OC) C = C6) N (C (C) C) C) C
Ngumiti si Isomeric
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
Inchi
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 (31-14-11-10-12-15-31,32-16-20-34 (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
Inchi key
Irrdhrzuoznwdj-mlldkzsosa-n
1 iba pang pangalan para sa sangkap na ito
Guanosine, 5 ′ -O-[bis (4-methoxyphenyl) phenylmethyl] -2 ′-O-methyl-N-.
Magagamit ang spectra
13 C NMR
Hetero nmr
Magagamit ang mga pag -aari
Biological
Kemikal
Lipinski
May kaugnayan sa istraktura
| Ari -arian | Halaga | Kundisyon | Pinagmulan |
| Bioconcentration factor | 183 | pH 1; Temp: 25 ° C. | (1) ACD |
| Bioconcentration factor | 3890 | Ph 2; Temp: 25 ° C. | (1) ACD |
| Bioconcentration factor | 35500 | Ph 3; Temp: 25 ° C. | (1) ACD |
| Bioconcentration factor | 1.08 x 105 | Ph 4; Temp: 25 ° C. | (1) ACD |
| Bioconcentration factor | 1.36 x 105 | Ph 5; Temp: 25 ° C. | (1) ACD |
| Bioconcentration factor | 1.39 x 105 | Ph 6; Temp: 25 ° C. | (1) ACD |
| Bioconcentration factor | 1.38 x 105 | Ph 7; Temp: 25 ° C. | (1) ACD |
| Bioconcentration factor | 1.24 x 105 | Ph 8; Temp: 25 ° C. | (1) ACD |
| Bioconcentration factor | 63600 | Ph 9; Temp: 25 ° C. | (1) ACD |
| Bioconcentration factor | 11900 | Ph 10; Temp: 25 ° C. | (1) ACD |
(1) Kinakalkula gamit ang Advanced Chemistry Development (ACD/Labs) Software v11.02 (© 1994-2023 ACD/Labs)
| Ari -arian | Halaga | Kundisyon | Pinagmulan |
| KOC | 220 | pH 1; Temp: 25 ° C. | (1) ACD |
| KOC | 4680 | Ph 2; Temp: 25 ° C. | (1) ACD |
| KOC | 42600 | Ph 3; Temp: 25 ° C. | (1) ACD |
| KOC | 1.30 x 105 | Ph 4; Temp: 25 ° C. | (1) ACD |
| KOC | 1.63 x 105 | Ph 5; Temp: 25 ° C. | (1) ACD |
| KOC | 1.67 x 105 | Ph 6; Temp: 25 ° C. | (1) ACD |
| KOC | 1.65 x 105 | Ph 7; Temp: 25 ° C. | (1) ACD |
| KOC | 1.49 x 105 | Ph 8; Temp: 25 ° C. | (1) ACD |
| Ari -arian | Halaga | Kundisyon | Pinagmulan |
| KOC | 76400 | Ph 9; Temp: 25 ° C. | (1) ACD |
| KOC | 14200 | Ph 10; Temp: 25 ° C. | (1) ACD |
| logd | 4.19 | pH 1; Temp: 25 ° C. | (1) ACD |
| logd | 5.52 | Ph 2; Temp: 25 ° C. | (1) ACD |
| logd | 6.48 | Ph 3; Temp: 25 ° C. | (1) ACD |
| logd | 6.96 | Ph 4; Temp: 25 ° C. | (1) ACD |
| logd | 7.06 | Ph 5; Temp: 25 ° C. | (1) ACD |
| logd | 7.07 | Ph 6; Temp: 25 ° C. | (1) ACD |
| logd | 7.07 | Ph 7; Temp: 25 ° C. | (1) ACD |
| logd | 7.02 | Ph 8; Temp: 25 ° C. | (1) ACD |
| logd | 6.73 | Ph 9; Temp: 25 ° C. | (1) ACD |
| logd | 6.00 | Ph 10; Temp: 25 ° C. | (1) ACD |
| Logp | 7.072 ± 0.721 | Temp: 25 ° C. | (1) ACD |
| Mass intrinsic solubility | 1.2 x 10-4 g/l | Temp: 25 ° C. | (1) ACD |
| Solubility ng Mass | 0.096 g/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Solubility ng Mass | 4.3 x 10-3 g/l | Ph 2; Temp: 25 ° C. | (1) ACD |
| Solubility ng Mass | 4.8 x 10-4 g/l | Ph 3; Temp: 25 ° C. | (1) ACD |
| Solubility ng Mass | 1.6 x 10-4 g/l | Ph 4; Temp: 25 ° C. | (1) ACD |
| Solubility ng Mass | 1.2 x 10-4 g/l | Ph 5; Temp: 25 ° C. | (1) ACD |
| Solubility ng Mass | 1.2 x 10-4 g/l | Ph 6; Temp: 25 ° C. | (1) ACD |
| Solubility ng Mass | 1.2 x 10-4 g/l | Ph 7; Temp: 25 ° C. | (1) ACD |
| Solubility ng Mass | 1.4 x 10-4 g/l | Ph 8; Temp: 25 ° C. | (1) ACD |
| Solubility ng Mass | 2.7 x 10-4 g/l | Ph 9; Temp: 25 ° C. | (1) ACD |
| Solubility ng Mass | 1.4 x 10-3 g/l | Ph 10; Temp: 25 ° C. | (1) ACD |
| Solubility ng Mass | 1.2 x 10-4 g/l | Hindi nabuong tubig pH 7.00; Temp: 25 ° C. | (1) ACD |
| Molar intrinsic solubility | 1.4 x 10-7 mol/l | Temp: 25 ° C. | (1) ACD |
| Molar solubility | 1.1 x 10-4 mol/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Molar solubility | 5.0 x 10-6 mol/l | Ph 2; Temp: 25 ° C. | (1) ACD |
| Molar solubility | 5.5 x 10-7 mol/l | Ph 3; Temp: 25 ° C. | (1) ACD |
| Molar solubility | 1.8 x 10-7 mol/l | Ph 4; Temp: 25 ° C. | (1) ACD |
| Molar solubility | 1.4 x 10-7 mol/l | Ph 5; Temp: 25 ° C. | (1) ACD |
| Molar solubility | 1.4 x 10-7 mol/l | Ph 6; Temp: 25 ° C. | (1) ACD |
| Ari -arian | Halaga | Kundisyon | Pinagmulan |
| Molar solubility | 1.4 x 10-7 mol/l | Ph 7; Temp: 25 ° C. | (1) ACD |
| Molar solubility | 1.6 x 10-7 mol/l | Ph 8; Temp: 25 ° C. | (1) ACD |
| Molar solubility | 3.1 x 10-7 mol/l | Ph 9; Temp: 25 ° C. | (1) ACD |
| Molar solubility | 1.6 x 10-6 mol/l | Ph 10; Temp: 25 ° C. | (1) ACD |
| Molar solubility | 1.4 x 10-7 mol/l | Hindi nabuong tubig pH 7.00; Temp: 25 ° C. | (1) ACD |
| Molekular na timbang | 869.94 | ||
| PKA | 9.16 ± 0.20 | Karamihan sa acidic temp: 25 ° C. | (1) ACD |
| PKA | 3.45 ± 0.70 | Karamihan sa mga pangunahing temp: 25 ° C. | (1) ACD |
(1) Kinakalkula gamit ang Advanced Chemistry Development (ACD/Labs) Software v11.02 (© 1994-2023 ACD/Labs)
| Ari -arian | Halaga | Kundisyon | Pinagmulan |
| Malayang rotatable bond | 19 | (1) ACD | |
| H Mga Tanggap | 16 | (1) ACD | |
| H donor | 2 | (1) ACD | |
| H Donor/Acceptor Sum | 18 | (1) ACD | |
| Logp | 7.072 ± 0.721 | Temp: 25 ° C. | (1) ACD |
| Molekular na timbang | 869.94 |
(1) Kinakalkula gamit ang Advanced Chemistry Development (ACD/Labs) Software v11.02 (© 1994-2023 ACD/Labs)
| Ari -arian | Halaga | Mapagkukunan ng kondisyon |
| Polar Surface Area | 194 A2 | (1) ACD |
(1) Kinakalkula gamit ang Advanced Chemistry Development (ACD/Labs) Software v11.02 (© 1994-2023 ACD/Labs)
Magagamit ang spectra
1 h nmr
13 C NMR
| Code | Pahayag ng peligro | Pinagmulan |
| H303 | Maaaring mapanganib kung nilamon | Curated Curated |
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