![C41H43N3O9 Cytidine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O- (2-methoxyethyl)-5-methyl- (9CI, ACI) H335, H319, H315](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C41H43N3O9 Cytidine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O- (2-methoxyethyl)-5-methyl- (9CI, ACI) H335, H319, H315 Ata Fa'aalia](https://cdn.globalso.com/nvchem/C41H43N3O9-Cytidine.jpg)
C41H43N3O9 Cytidine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O- (2-methoxyethyl)-5-methyl- (9CI, ACI) H335, H319, H315
| Meatotino Faaletino Autu | Taua | Tulaga |
| Molecular Weight | 721.80 | - |
| Lisi Lisi (Fa'ata'ita'i) | 107-110 °C | - |
| To'atele (Va'ai) | 1.26±0.1 g/cm3 | Maalili: 20 °C; Lomitusi: 760 Torr |
| pKa (vala'aina) | 8.60±0.40 | Le Tele o le Asi Sua: 25 °C |
O'O'ITA'I Canonical O=C1N=C(NC(=O)C=2C=CC=CC2)C(=CN1C3OC(COC(C=4C=CC=CC4)(C5=CC=C(OC)C=C5)C6 =CC=C(OC)C=C6)C(O)C3OCCOC)C
Isomeric SMILES
C(OC[C@H]1O[C@H]([C@H](OCCOC)[C@@H]1O)N2C(=O)N=C(NC(=O)C3=CC=CC =C3)C(C)=C2)(C4=CC=C(OC)C=C4)(C5=CC=C(OC)C=C5) C6=CC=CC=C6
InChI
InChI=1S/C41H43N3O9/c1-27-25-44(40(47)43-37(27)42-38(46)28-11-7-5-8-12-28)39-36(51- 24-23-48-2)35(45)34(53-39)26-52-41(29-13)
-9-6-10-14-29,30-15-19-32(49-3)20-16-30)31-17-21-33(50-4)22-18-31/h5-22 ,25,34-36,39,45H,23-24,26H2,1-4H3,(H,42,43,46,47)/t34-,3 5-,36-,39-/m1/s1
InChI Ki
BYSCLUAIKFEFAH-LZURGKRNSA-N
23 Isi Igoa mo lea mea
N-Benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2-methoxyethyl)-5-methylcytidine (ACI); 10: PN: WO03084478 ITULAU: 57 fai mai RNA; 12: PN: US20030170636 ITULAU: 17 fai mai R NA; 13: PN: US20030212017 ITULAU: 19 fai mai R NA; 14: PN: US20030
211606 ITULAU: 19 fai mai R NA; 15: PN: US20040005569 ITULAU: 22 fai mai R NA; 16: PN: US20040006030 ITULAU: 22 fai mai R NA; 16: PN: US20040014048 ITULAU: 20 fai mai R NA; 17: PN: US20030171313 ITULAU: 9 fai mai R NA; 17: PN: US20040005565 ITULAU: 17- 22 fai mai RNA; 17: PN: US20040005570 ITULAU: 20 fai mai R NA; 17: PN: US20040014047 ITULAU: 20 fai mai R NA; 17: PN: US20040 014050 ITULAU: 20 fai mai R NA; 18: PN: US20030198965 ITULAU: 19 fai mai R NA; 18: PN: US20040014699 ITULAU: 20 fai mai R NA; 19: PN: US20040006029 ITULAU: 23 fai mai R NA; 19: PN: WO03106645 ITULAU: 71 fai mai R NA; 59: PN: US20030166592 ITULAU: 15 fai mai RNA; 6: PN: WO2005006958 ITULAU: 62 fai mai R NA; 83: PN: US20040171566 ITULAU: 18 fai mai R NA; 8: PN: WO2005007825
ITULAU: 62 fai mai R NA; 90: PN: US20040005707 ITULAU: 20 fai mai R NA; N4-Benzoyl-2′-O-methoxyethyl-5′-O-dimethoxytriyl-5-
methylcytidine
| Meatotino avanoa |
| Mafanafana |
Mafanafana
| Meatotino | Taua | Tulaga | Punavai |
| Lisi Lisi | 107-110 °C | (1) CAS | |
(1) Penjarla, Srishylam; Nucleosides, Nucleotides & Nucleic Acids, (2018), 37(4), 232-247, CAplus
Spectra avanoa
1H NMR
13C NMR
| Meatotino avanoa |
| Biological |
| Kemisi |
| Malosi |
| Lipinski |
| Fauga Faatatau |
Biological
| Meatotino | Taua | Tulaga | Punavai |
| Bioconcentration Factor | 291 | pH 1; Maalili: 25 °C | (1) ACD |
| Bioconcentration Factor | 644 | pH 2; Maalili: 25 °C | (1) ACD |
| Bioconcentration Factor | 3690 | pH 3; Maalili: 25 °C | (1) ACD |
| Bioconcentration Factor | 15600 | pH 4; Maalili: 25 °C | (1) ACD |
| Bioconcentration Factor | 23700 | pH 5; Maalili: 25 °C | (1) ACD |
| Bioconcentration Factor | 24800 | pH 6; Maalili: 25 °C | (1) ACD |
| Meatotino | Taua | Tulaga | Punavai |
| Bioconcentration Factor | 23300 | pH 7; Maalili: 25 °C | (1) ACD |
| Bioconcentration Factor | 14100 | pH 8; Maalili: 25 °C | (1) ACD |
| Bioconcentration Factor | 3010 | pH 9; Maalili: 25 °C | (1) ACD |
| Bioconcentration Factor | 558 | pH 10; Maalili: 25 °C | (1) ACD |
(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)
Kemisi
| Meatotino | Taua | Tulaga | Punavai |
| Koc | 569 | pH 1; Maalili: 25 °C | (1) ACD |
| Koc | 1260 | pH 2; Maalili: 25 °C | (1) ACD |
| Koc | 7210 | pH 3; Maalili: 25 °C | (1) ACD |
| Koc | 30400 | pH 4; Maalili: 25 °C | (1) ACD |
| Koc | 46300 | pH 5; Maalili: 25 °C | (1) ACD |
| Koc | 48500 | pH 6; Maalili: 25 °C | (1) ACD |
| Koc | 45500 | pH 7; Maalili: 25 °C | (1) ACD |
| Koc | 27500 | pH 8; Maalili: 25 °C | (1) ACD |
| Koc | 5890 | pH 9; Maalili: 25 °C | (1) ACD |
| Koc | 1090 | pH 10; Maalili: 25 °C | (1) ACD |
| ogalaauD | 4.16 | pH 1; Maalili: 25 °C | (1) ACD |
| ogalaauD | 4.50 | pH 2; Maalili: 25 °C | (1) ACD |
| ogalaauD | 5.26 | pH 3; Maalili: 25 °C | (1) ACD |
| ogalaauD | 5.88 | pH 4; Maalili: 25 °C | (1) ACD |
| ogalaauD | 6.07 | pH 5; Maalili: 25 °C | (1) ACD |
| ogalaauD | 6.09 | pH 6; Maalili: 25 °C | (1) ACD |
| ogalaauD | 6.06 | pH 7; Maalili: 25 °C | (1) ACD |
| ogalaauD | 5.84 | pH 8; Maalili: 25 °C | (1) ACD |
| ogalaauD | 5.17 | pH 9; Maalili: 25 °C | (1) ACD |
| ogalaauD | 4.44 | pH 10; Maalili: 25 °C | (1) ACD |
| logP | 6.093±0.720 | Maalili: 25 °C | (1) ACD |
| Mass Intrinsic Solubility | 1.3 x 10-4 g/L | Maalili: 25 °C | (1) ACD |
| Mass Solubility | 0.011 g/L | pH 1; Maalili: 25 °C | (1) ACD |
| Mass Solubility | 5.0 x 10-3 g/L | pH 2; Maalili: 25 °C | (1) ACD |
| Mass Solubility | 8.7 x 10-4 g/L | pH 3; Maalili: 25 °C | (1) ACD |
| Mass Solubility | 2.1 x 10-4 g/L | pH 4; Maalili: 25 °C | (1) ACD |
| Meatotino | Taua | Tulaga | Punavai |
| Mass Solubility | 1.4 x 10-4 g/L | pH 5; Maalili: 25 °C | (1) ACD |
| Mass Solubility | 1.3 x 10-4 g/L | pH 6; Maalili: 25 °C | (1) ACD |
| Mass Solubility | 1.4 x 10-4 g/L | pH 7; Maalili: 25 °C | (1) ACD |
| Mass Solubility | 2.3 x 10-4 g/L | pH 8; Maalili: 25 °C | (1) ACD |
| Mass Solubility | 1.1 x 10-3 g/L | pH 9; Maalili: 25 °C | (1) ACD |
| Mass Solubility | 5.8 x 10-3 g/L | pH 10; Maalili: 25 °C | (1) ACD |
| Mass Solubility | 1.4 x 10-4 g/L | Suavai e le fa'asaoina pH 6.97; Maalili: 25 °C | (1) ACD |
| Molar Intrinsic Solubility | 1.8 x 10-7 mol/L | Maalili: 25 °C | (1) ACD |
| Molar Solubility | 1.5 x 10-5 mol/L | pH 1; Maalili: 25 °C | (1) ACD |
| Molar Solubility | 6.9 x 10-6 mol/L | pH 2; Maalili: 25 °C | (1) ACD |
| Molar Solubility | 1.2 x 10-6 mol/L | pH 3; Maalili: 25 °C | (1) ACD |
| Molar Solubility | 2.9 x 10-7 mol/L | pH 4; Maalili: 25 °C | (1) ACD |
| Molar Solubility | 1.9 x 10-7 mol/L | pH 5; Maalili: 25 °C | (1) ACD |
| Molar Solubility | 1.8 x 10-7 mol/L | pH 6; Maalili: 25 °C | (1) ACD |
| Molar Solubility | 1.9 x 10-7 mol/L | pH 7; Maalili: 25 °C | (1) ACD |
| Molar Solubility | 3.2 x 10-7 mol/L | pH 8; Maalili: 25 °C | (1) ACD |
| Molar Solubility | 1.5 x 10-6 mol/L | pH 9; Maalili: 25 °C | (1) ACD |
| Molar Solubility | 8.0 x 10-6 mol/L | pH 10; Maalili: 25 °C | (1) ACD |
| Molar Solubility | 1.9 x 10-7 mol/L | Suavai e le fa'asaoina pH 6.97; Maalili: 25 °C | (1) ACD |
| Molecular Weight | 721.80 | ||
| pKa | 8.60±0.40 | Le Tele o le Asi Sua: 25 °C | (1) ACD |
| pKa | 3.87±0.20 | Tele Su'esu'ega Autu: 25 °C | (1) ACD |
(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)
Malosi
| Meatotino | Taua | Tulaga | Punavai |
| Malosi | 1.26±0.1 g/cm3 | Maalili: 20 °C; Lomitusi: 760 Torr | (1) ACD |
| Molar Volume | 572.5±7.0 cm3/mol | Maalili: 20 °C; Lomitusi: 760 Torr | (1) ACD |
(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Meatotino | Taua | Tulaga | Punavai |
| Noanoaga e mafai ona fesuia'i saoloto | 15 | (1) ACD | |
| Meatotino | Taua | Tulaga | Punavai |
| H Tagata talia | 12 | (1) ACD | |
| H Donors | 2 | (1) ACD | |
| H Fa'ameaalofa/Tagata Talia | 14 | (1) ACD | |
| logP | 6.093±0.720 | Maalili: 25 °C | (1) ACD |
| Molecular Weight | 721.80 |
(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)
Fauga Faatatau
| Meatotino | Taua | Tulaga | Punavai |
| Polar Surface Area | 137 A2 | (1) ACD | |
(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)
Spectra avanoa
1H NMR
13C NMR
| Code | Fa'amatalaga o Tulaga Lamatia | Punavai |
| H335 | E ono mafua ai le manava manava | European Chemical Agency (ECHA) Fa'avasegaina & Fa'ailoga Fa'ailoga - Fa'ailoaina le fa'avasegaina ma le fa'ailoga - fa'amatalaga sili ona taatele, European Chemical Agency (ECHA) Fa'avasegaina & Fa'ailoga Fa'ailoga - Fa'ailoa le fa'avasegaina ma le fa'ailoga - fa'amatalaga sili ona ogaoga. |
| H319 | E mafua ai le tiga mata'utia | European Chemical Agency (ECHA) Fa'avasegaina & Fa'ailoga Fa'ailoga - Fa'ailoaina le fa'avasegaina ma le fa'ailoga - fa'amatalaga sili ona taatele, European Chemical Agency (ECHA) Fa'avasegaina & Fa'ailoga Fa'ailoga - Fa'ailoa le fa'avasegaina ma le fa'ailoga - fa'amatalaga sili ona ogaoga. |
| H315 | E mafua ai le afaina o le paʻu | European Chemical Agency (ECHA) Fa'avasegaina & Fa'ailoga Fa'ailoga - Fa'ailoaina le fa'avasegaina ma le fa'ailoga - fa'amatalaga sili ona taatele, European Chemical Agency (ECHA) Fa'avasegaina & Fa'ailoga Fa'ailoga - Fa'ailoa le fa'avasegaina ma le fa'ailoga - fa'amatalaga sili ona ogaoga. |
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