C42H39N3O8 Har yanzu Ba a Sanya shi ba
| Mabuɗin Abubuwan Jiki | Daraja | Sharadi |
| Nauyin Kwayoyin Halitta | 713.78 | - |
| Girma (An annabta) | 1.315± 0.06 g/cm3 | Zazzabi: 20 ° C; Latsa: 760 Torr |
| pKa (An annabta) | 8.23± 0.10 | Mafi yawan zafin jiki: 25 ° C |
Canonical SMILES O=C1NC(=O)N(C=C1C(=O)NCC2=CC=CC=3C=CC=CC32)C4OC(COC(C=5C=CC=CC5)(C6=CC=C(OC) )C=C6)C7=CC=C(OC)C=C7)C(O)C4
MURMUSHI
C(OC[C@H]1O[C@H](C[C@@H]1O)N2C=C(C(NCC=3C4=C(C=CC3)C=CC=C4)=O)C (=O)NC2=O)(C5=CC=C(OC)C=C5)(C6=CC=C(OC)C=C6)C 7=CC=CC=C7
InChi
InChi=1S/C42H39N3O8/c1-50-32-19-15-30(16-20-32)42(29-12-4-3-5-13-29,31-17-21-33(51- 2)22-18-31)52-26-37-36(46)23-38(53-37)4 5-25-35(40(48)44-41(45)49)39(47)43 -24-28-11-8-10-27-9-6-7-14-34(27)28/h3-22,25,36-38,46H,23-24,26H2,1-2H3,( H,43,47) (H,44,48,49)/t36-,37+,38+/m0/s1
InChi Key
HDUMRQQRYJOBFS-YXWIYCFASA-N
| Properties akwai |
| Halittu |
| Properties akwai |
| Chemical |
| Yawan yawa |
| Lipinski |
| Tsarin Yanayi |
Halittu
| Dukiya | Daraja | Sharadi | Source |
| Factor na Bioconcentration | 41700 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 41700 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 41700 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 41700 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 41700 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 41200 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 36900 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 18100 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 3290 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 718 | pH 10; Zazzabi: 25 ° C | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Chemical
| Dukiya | Daraja | Sharadi | Source |
| Koc | 70600 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Koc | 70600 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Koc | 70600 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Koc | 70600 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Koc | 70500 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Koc | 69700 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Koc | 62400 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Koc | 30600 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Koc | 5560 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Koc | 1210 | pH 10; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.38 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.38 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.38 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Dukiya | Daraja | Sharadi | Source |
| logD | 6.38 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.38 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.38 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.33 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.02 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| logD | 5.28 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| logD | 4.62 | pH 10; Zazzabi: 25 ° C | (1) ACD |
| logP | 6.382± 0.644 | Zazzabi: 25 ° C | (1) ACD |
| Mass Intrinsic Solubility | 5.1 x 10-7 g/L | Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 5.1 x 10-7 g/L | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 5.1 x 10-7 g/L | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 5.1 x 10-7 g/L | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 5.1 x 10-7 g/L | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 5.1 x 10-7 g/L | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 5.1 x 10-7 g/L | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 5.7 x 10-7 g/L | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 1.1 x 10-6 g/L | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 6.4 x 10-6 g/L | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 2.9 x 10-5 g/L | pH 10; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 5.7 x 10-7 g/L | Ruwan da ba a buguwa pH 7.00; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Ciki na Molar | 7.1 x 10-10 mol/L | Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 7.1 x 10-10 mol/L | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 7.1 x 10-10 mol/L | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 7.1 x 10-10 mol/L | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 7.1 x 10-10 mol/L | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 7.1 x 10-10 mol/L | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 7.2 x 10-10 mol/L | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 8.0 x 10-10 mol/L | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 1.6 x 10-9 mol/L | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 9.0 x 10-9 mol/L | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 4.1 x 10-8 mol/L | pH 10; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 8.0 x 10-10 mol/L | Ruwan da ba a buguwa pH 7.00; Zazzabi: 25 ° C | (1) ACD |
| Dukiya | Daraja | Sharadi | Source |
| Nauyin Kwayoyin Halitta | 713.78 | ||
| pKa | 8.23± 0.10 | Mafi yawan zafin jiki: 25 ° C | (1) ACD |
| pKa | -1.90±0.20 | Mafi Asalin Zazzabi: 25 ° C | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Yawan yawa
| Dukiya | Daraja | Sharadi | Source |
| Yawan yawa | 1.315± 0.06 g/cm3 | Zazzabi: 20 ° C; Latsa: 760 Torr | (1) ACD |
| Ƙarar Molar | 542.7± 3.0 cm3/mol | Zazzabi: 20 ° C; Latsa: 760 Torr | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Dukiya | Daraja | Sharadi | Source |
| Ƙimar Rarraba Kyauta | 13 | (1) ACD | |
| H Masu karɓa | 11 | (1) ACD | |
| H Masu Ba da taimako | 3 | (1) ACD | |
| H Donor/Acceptor Sum | 14 | (1) ACD | |
| logP | 6.382± 0.644 | Zazzabi: 25 ° C | (1) ACD |
| Nauyin Kwayoyin Halitta | 713.78 |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Tsarin Yanayi
| Dukiya | Daraja | Sharadi | Source |
| Wuri Mai Girma | 136 A2 | (1) ACD | |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra akwai
1H NMR
13C NMR
![C41H41N5O8 Adenosine, N-benzoyl-5′-O-[bis (4-methoxyphenyl) phenylmethyl]-2′- O- (2-methoxyethyl) - (9CI, ACI)](https://cdn.globalso.com/nvchem/C41H41N5O8-Adenosine-300x300.jpg)
![C41H43N3O9 Cytidine, N-benzoyl-5'-O-[bis (4-methoxyphenyl) phenylmethyl]-2'-O- (2-methoxyethyl) -5-methyl- (9CI, ACI) H335, H319, H315](https://cdn.globalso.com/nvchem/C41H43N3O9-Cytidine-300x300.jpg)
![C34H39N3O8 Cytidine, 5'-O-[bis (4-methoxyphenyl) phenylmethyl] -2'-O- (2-methox yethyl) -5-methyl- (9CI, ACI)](https://cdn.globalso.com/nvchem/C34H39N3O8-Cytidine-300x300.jpg)
![C33H39N5O6 L-Ornithinamide, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-valyl-N5- (aminocarbonyl) -N-[4- (hydroxymethyl) phenyl] - (9CI, ACI)](https://cdn.globalso.com/nvchem/C33H39N5O6-L-Ornithinamide-300x300.jpg)
![C42H52N5O9P Cytidine, N-acetyl-5'-O- [bis (4-methoxyphenyl) phenylmethyl] -2'-O- methyl-, 3'- [2-cyanoethyl N, N-bis (1-methylethyl) phosphoramidite] ( ACI)](https://cdn.globalso.com/nvchem/C42H52N5O9P-Cytidine-300x300.png)