![C33H35N3O8 Cytidine, N-acetyl-5′-O-[bis(4-methoxyphenyl) phenylmethyl]-2′-O- methyl- (9CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C33H35N3O8 Cytidine, N-acetyl-5′-O-[bis(4-methoxyphenyl) phenylmethyl]-2′-O- methyl- (9CI, ACI) Foto egosipụtara](https://cdn.globalso.com/nvchem/C33H35N3O8-Cytidine.jpg)
C33H35N3O8 Cytidine, N-acetyl-5′-O-[bis(4-methoxyphenyl) phenylmethyl]-2′-O- methyl- (9CI, ACI)
| Njirimara anụ ahụ igodo | Uru | Ọnọdụ |
| Ibu molekụla | 601.65 | - |
| Njupụta (buru amụma) | 1.28±0.1 g/cm3 | Okpomọkụ: 20 °C; Pịa: 760 Torr |
| pKa (buru amụma) | 10.19± 0.20 | Okpomọkụ kachasị acidic: 25 Celsius |
Canonical SMILES O=C1N=C(C=CN1C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C=C5)C(O)C2OC)NC(=O)C
Isomeric SMILES C (OC [C @ H] 1O[C @ H] ([C @ H] (OC) [C@@H] 1O) N2C (= O) N = C (NC(C)=O)C = C2)
InChi
InChi=1S/C33H35N3O8/c1-21(37)34-28-18-19-36(32(39)35-28)31-30( 42-4)29 (38)27 (44-31)20-43-33 (22-8-6-5-7-9-22,23-10-14-25(40-2) 15-11-23)24-12-16-26(41-3)17-13-24/h5-19,27,29-31,38H,20H2,1-4H3,(H,34,35,37,39)/t27-,29-,30-,31-,31
Igodo InChi
FINUHOJILDNELQ-PMFUCWTESA-N
1 Aha ọzọ maka ihe a
N-Acetyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methylcytidine (ACI)
| Ngwongwo dị |
| Usoro ndu |
| Chemical |
| Njupụta |
| Lipinski |
| Ọdịdị metụtara |
Usoro ndu
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Ihe kpatara bioconcentration | 8.87 | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 27.8 | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 171 | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 515 | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 650 | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 668 | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 668 | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 657 | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 560 | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 229 | 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 | 48.6 | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 152 | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 935 | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 2820 | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 3560 | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 3660 | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 3660 | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 3600 | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 3070 | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 1250 | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 2.14 | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 2.64 | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| logD | 3.43 | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 3.91 | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.01 | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.02 | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.02 | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.01 | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 3.94 | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 3.55 | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| logP | 4.021± 0.768 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ọkachamara Solubility dị n'ime | 1.3 x 10-3 g/L | Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0.10 g/L | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0.032 g/L | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 5.2 x 10-3 g/L | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.7 x 10-3 g/L | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.4 x 10-3 g/L | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.3 x 10-3 g/L | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.3 x 10-3 g/L | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.3 x 10-3 g/L | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.6 x 10-3 g/L | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.9 x 10-3 g/L | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.3 x 10-3 g/L | Mmiri na-enweghị atụ pH 6.99; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility dị n'ime Molar | 2.2 x 10-6 mol/L | Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.7 x 10-4 mol / l | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 5.3 x 10-5 mol / l | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 8.6 x 10-6 mol/L | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 2.9 x 10-6 mol/L | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 2.3 x 10-6 mol/L | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 2.2 x 10-6 mol/L | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 2.2 x 10-6 mol/L | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 2.2 x 10-6 mol/L | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 2.6 x 10-6 mol/L | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 6.4 x 10-6 mol/L | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Solubility Molar | 2.2 x 10-6 mol/L | Mmiri na-enweghị atụ pH 6.99; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 601.65 | ||
| pKa | 10.19± 0.20 | Okpomọkụ kachasị acidic: 25 Celsius | (1) ACD |
| pKa | 3.57± 0.20 | 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 | 1.28±0.1 g/cm3 | Okpomọkụ: 20 °C; Pịa: 760 Torr | (1) ACD |
| Olu Molar | 466.5± 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 | 11 | (1) ACD | |
| H Ndị nnabata | 11 | (1) ACD | |
| H Ndị na-enye onyinye | 2 | (1) ACD | |
| H Donor/Anabata Nchikota | 13 | (1) ACD | |
| logP | 4.021± 0.768 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 601.65 |
(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 | 128 A2 | (1) ACD | |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra dị
1H NMR
13C NMR
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