![C50H60N5O10P Cytidine, N-benzoyl-5′-O- [bis (4-methoxyphenyl) phenylmethyl]-2′-O- (2-methoxyethyl) – 5-methyl-, 3′ – [2-cyanoethyl N, N-bis (1-methylethyl) phosphoramite (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C50H60N5O10P Cytidine, N-benzoyl-5′-O- [bis (4-methoxyphenyl) phenylmethyl]-2′-O- (2-methoxyethyl) – 5-methyl-, 3′ – [2-cyanoethyl N, N-bis (1-methylethyl) phosphoramite] (ACI) Foto egosipụtara](https://cdn.globalso.com/nvchem/C50H60N5O10P-Cytidine.png)
C50H60N5O10P Cytidine, N-benzoyl-5′-O- [bis (4-methoxyphenyl) phenylmethyl]-2′-O- (2-methoxyethyl) – 5-methyl-, 3′ – [2-cyanoethyl N, N-bis (1-methylethyl) phosphoramite (ACI)
Nọmba ndekọ CAS
163759-94-2
| Njirimara anụ ahụ igodo | Uru | Ọnọdụ |
| Ibu molekụla | 922.01 | - |
| pKa (buru amụma) | 8.59± 0.40 | Okpomọkụ kachasị acidic: 25 Celsius |
Ọchịchị Canonical
N#CCCOP(OC1C(OC(N2C=C(C(= NC2=O))NC(=O)C=3C=CC=CC3)C)C1OCCOC)COC(C=4C=CC=CC4)(C5=CC) =C(OC)C=C5)C6=CC=C(OC)C=C 6)N(C(C)C)C(C)C
Isomeric SMILES
C(OC[C@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](OCCOC)[C@@ H](O1)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/C50H60N5O10P/c1-34(2)55(35(3)4)66(63-29-15-28-51)65-44-43(33-62-50(38-18-13-) 10-14-19-38,39-20-24-41(59-7)25-21-39 )40-22-26-42(60-8)27-23-40)64-48(45(45) 44)61-31-30-58-6)54-32-36(5)46(53-49(54)57)52-47(56)37-16-11-9-12-17-37/ h9-14,16-27,32,34- 35,43-45,48H,15,29-31,33H2,1-8H3,(H,52,53,56,57)/t43-,44-, 45-,48-,66?/m1/s1
Igodo InChi
FLIGVMLIIDVDSN-GICDFOIUSA-N
26 Aha ndị ọzọ maka ihe a
Cytidine,Nbenzoyl-5′O- [bis (4-methoxyphenyl) phenylmethyl] -2′ -O(2-methoxyethyl) - 5-methyl-, 3 '- [2-cyanoethyl bis (1-methylethyl) phosphoramite] (9CI); 12: PN: WO03084478 PEEJI: 57 kwuru DNA; 14: PN: US20030170636 PEEJI: 17 kwuru DNA; 15: PN: U
S20030211606 PEEJI: 19 kwuru DNA; 15: PN: US20030212017 PEEJI: 19 kwuru DNA; 16: PN: US20040005569 PEEJI: 22 kwuru DNA; 17: PN: US20040006030 PEEJI: 23 kwuru DNA; 17: PN: US20040014049 PEEJI: 20 kwuru DNA; 18: PN: US20040014047 PAG E: 20 kwuru DNA; 18: PN: US20040014048 PEEJI: 20 kwuru DNA; 18: PN: US20040014050 PEEJI: 20 kwuru DNA; 19: PN: U
S20030171313 PEEJI: 9 kwuru DNA; 19: PN: US20030198965 PEEJI: 20 kwuru DNA; 19: PN: US20040005565 PEEJI: 17- 22 kwuru DNA; 19: PN: US20040005570 PEEJI: 20 kwuru DNA; 19: PN: US20040014051 PEEJI: 22 kwuru DNA; 20: PN: US20040014699 PAG
E: 20 DNA kwuru; 21: PN: US20040006029 PEEJI: 23 kwuru DNA; 21: PN: WO03106645 PEEJI: 72 kwuru DNA; 61: PN: US20030
166592 PEEJI: 15 kwuru DNA; 7: PN: WO2005006958 PEEJI: 62 kwuru DNA; 84: PN: US20040171566 PEEJI: 18 kwuru DNA; 92:
PN: US20040005707 PEEJI: 20 DNA kwuru; 9: PN: WO2005007825 PEEJI: 62 kwuru DNA;N4-Benzoyl-2′-OMethoxyethyl-5-O- dimethoxytrityl-5-methylcytidine-3′-phosphoramide;N4-Benzoyl-2′-OMethoxyethyl-5′O-dimethoxytrityl-5-methylcytidine-3′ - amide
Spectra dị
13C NMR
Hetero NMR
Ngwongwo dị
Usoro ndu
Chemical
Lipinski
Ọdịdị metụtara
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Ihe kpatara bioconcentration | 171 | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1250 | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 47600 | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 6,44 x 105 | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.00 x 106 | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.00 x 106 | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.00 x 106 | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 7,79 x 105 | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.63 x 105 | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 30800 | 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)
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Koc | 106 | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 773 | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 29500 | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Koc | 3,99 x 105 | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 8.02 x 105 | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 8,70 x 105 | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 8,16 x 105 | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 4,83 x 105 | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 1.01 x 105 | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 19100 | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.48 | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 5.34 | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 6.92 | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 8.06 | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 8.36 | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 8.39 | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 8.37 | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 8.14 | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 7.46 | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 6.73 | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| logP | 8.401± 0.723 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ọkachamara Solubility dị n'ime | 1.4 x 10-4 g/L | Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.1 g/L | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0.16 g/L | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 4.1 x 10-3 g/L | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.0 x 10-4 g/L | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.5 x 10-4 g/L | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.4 x 10-4 g/L | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.5 x 10-4 g/L | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 2.5 x 10-4 g/L | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.2 x 10-3 g/L | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 6.3 x 10-3 g/L | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.5 x 10-4 g/L | Mmiri na-enweghị atụ pH 6.97; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility dị n'ime Molar | 1.5 x 10-7 mol / l | Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.2 x 10-3 mol / l | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Solubility Molar | 1.7 x 10-4 mol / l | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 4.4 x 10-6 mol/L | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 3.2 x 10-7 mol / l | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.6 x 10-7 mol / l | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.5 x 10-7 mol / l | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.6 x 10-7 mol / l | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 2.7 x 10-7 mol / l | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.3 x 10-6 mol/L | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 6.8 x 10-6 mol/L | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.6 x 10-7 mol / l | Mmiri na-enweghị atụ pH 6.97; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 922.01 | ||
| pKa | 8.59± 0.40 | Okpomọkụ kachasị acidic: 25 Celsius | (1) ACD |
| pKa | 3.87± 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)
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Nkwekọrịta na-agbanwe agbanwe n'efu | 22 | (1) ACD | |
| H Ndị nnabata | 15 | (1) ACD | |
| H Ndị na-enye onyinye | 1 | (1) ACD | |
| H Donor/Anabata Nchikota | 16 | (1) ACD | |
| logP | 8.401± 0.723 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 922.01 |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ngwongwo | Uru | Isi mmalite ọnọdụ |
| Mpaghara elu elu | 176 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
![C40H49N4O9P Uridine, 5′-O- [bis (4-methoxyphenyl) phenylmethyl] -2′ -O-methyl-, 3′ – [2-cyanoethyl N, N-bis (1-methylethyl) phosphoramidite] (ACI)](https://cdn.globalso.com/nvchem/C40H49N4O9P-Uridine-300x300.png)
![C36H39N5O8 Guanosine, 5'-O-[bis (4-methoxyphenyl) phenylmethyl] -2'-O-methyl- N- (2-methyl-1-oxopropyl) - (9CI, ACI)](https://cdn.globalso.com/nvchem/C36H39N5O8-Guanosine-300x300.jpg)
![C33H35N3O8 Cytidine, N-acetyl-5′-O-[bis(4-methoxyphenyl) phenylmethyl]-2′-O- methyl- (9CI, ACI)](https://cdn.globalso.com/nvchem/C33H35N3O8-Cytidine-300x300.jpg)
![C50H58N7O9P Adenosine, N-benzoyl-5′-O- [bis (4-methoxyphenyl) phenylmethyl] -2′ – O- (2-methoxyethyl) –, 3′ – [2-cyanoethyl N, N-bis (1-methylethyl). phosphoramite] (ACI)](https://cdn.globalso.com/nvchem/C50H58N7O9P-Adenosine-300x300.png)
![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)