C15H21N5O6 Guanosin, 2'-O-methyl-N- (2-methyl-1-oxopropyl) - (9CI, ACI)
| Njirimara anụ ahụ igodo | Uru | Ọnọdụ |
| Ibu molekụla | 367.36 | - |
| Njupụta (buru amụma) | 1.68±0.1 g/cm3 | Okpomọkụ: 20 °C; Pịa: 760 Torr |
| pKa (buru amụma) | 9.16±0.20 | Okpomọkụ kachasị acidic: 25 Celsius |
Canonical SILES O=C1N=C(NC(=O)C(C)C)NC2=C1N=CN2C3OC(CO)C(O)C3OC
Isomeric SMILES O(C)[C@H]1[C@H](N2C3=C(N=C2)C(=O)N=C(NC(C(C)C)=O)N3)O[ C@H](CO)[C@H]1O
InChi
InChi=1S/C15H21N5O6/c1-6(2)12(23)18-15-17-11-8(13(24)19-15)16-5-20(11)14-10(25-3) 9 (22) 7 (4-21) 26-14/h5-7,9-10,14,21- 22H,4H2,1-3H3,(H2,17,18,19,23,24)/t7-,9-,10-,14-/m1/s1
Igodo InChi
RPULCYXEYODQOG-AKAIJSEGSA-N
2 Aha ndị ọzọ maka ihe a
2′-O-Methyl-N(2-methyl-1-oxopropyl) guanosine (ACI);N2-Isobutyryl-2′-O- methylguanosin
Spectra dị
1H NMR
13C NMR
Mass
| Ngwongwo dị |
| Usoro ndu |
| Chemical |
| Njupụta |
| Lipinski |
| Ọdịdị metụtara |
Usoro ndu
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Ihe kpatara bioconcentration | 1.0 | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Chemical
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Koc | 2.12 | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 8.67 | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 12.6 | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 13.3 | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 13.3 | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 13.3 | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 13.2 | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Koc | 12.5 | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 7.85 | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 1.76 | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -1.26 | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -0.65 | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -0.49 | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -0.47 | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -0.46 | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -0.46 | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -0.47 | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -0.49 | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -0.69 | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -1.34 | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| logP | -0.464±0.636 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ọkachamara Solubility dị n'ime | 0,55 g/L | Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.5 g/L | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0.84 g/L | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0.59 g/L | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0,55 g/L | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0,55 g/L | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0,55 g/L | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0,55 g/L | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0.59 g/L | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0.96 g/L | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 4.4 g/L | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0,55 g/L | Mmiri na-enweghị atụ pH 6.00; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility dị n'ime Molar | 1.5 x 10-3 mol / l | Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 9.6 x 10-3 mol/L | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 2.3 x 10-3 mol / l | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.6 x 10-3 mol / l | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.5 x 10-3 mol / l | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.5 x 10-3 mol / l | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Solubility Molar | 1.5 x 10-3 mol / l | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.5 x 10-3 mol / l | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.6 x 10-3 mol / l | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 2.6 x 10-3 mol / l | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 0.012 mol / l | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.5 x 10-3 mol / l | Mmiri na-enweghị atụ pH 6.00; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 367.36 | ||
| pKa | 9.16±0.20 | Okpomọkụ kachasị acidic: 25 Celsius | (1) ACD |
| pKa | 1.73± 0.10 | Okpomọkụ kachasị mma: 25 Celsius | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Njupụta
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Njupụta | 1.68±0.1 g/cm3 | Okpomọkụ: 20 °C; Pịa: 760 Torr | (1) ACD |
| Olu Molar | 217.6± 7.0 cm3 / mol | Okpomọkụ: 20 °C; Pịa: 760 Torr | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Nkwekọrịta na-agbanwe agbanwe n'efu | 6 | (1) ACD | |
| H Ndị nnabata | 11 | (1) ACD | |
| H Ndị na-enye onyinye | 4 | (1) ACD | |
| H Donor/Anabata Nchikota | 15 | (1) ACD | |
| logP | -0.464±0.636 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 367.36 |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Ọdịdị metụtara
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Mpaghara elu elu | 147 A2 | (1) ACD | |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra dị
1H NMR
Spectra dị
13C NMR
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