![C44H49N5O7Si Adenosine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′- O-[(1,1-dimethylethyl)dimethylsilyl]- (9CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C44H49N5O7Si Adenosine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′- O-[(1,1-dimethylethyl)dimethylsilyl]- (9CI, ACI) ຮູບພາບແນະນໍາ](https://cdn.globalso.com/nvchem/C44H49N5O7Si-Adenosine.jpg)
C44H49N5O7Si Adenosine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′- O-[(1,1-dimethylethyl)dimethylsilyl]- (9CI, ACI)
| ຄຸນສົມບັດທາງກາຍະພາບທີ່ສໍາຄັນ | ມູນຄ່າ | ສະພາບ |
| ນ້ຳໜັກໂມເລກຸນ | 787.98 | - |
| ຄວາມໜາແໜ້ນ (ຄາດຄະເນ) | 1.23±0.1 g/cm3 | ອຸນຫະພູມ: 20 °C;ກົດ: 760 Torr |
| pKa (ຄາດຄະເນ) | 7.87±0.43 | ອຸນຫະພູມອາຊິດຫຼາຍທີ່ສຸດ: 25 °C |
Canonical smiles
O=C(NC1=NC=NC2=C1N=CN2C3OC(COC(C=4C=CC=CC4))(C5=CC=C(OC)C=C5)C6=CC=C(OC)C=C6)C (O)C3O[Si](C)(C)C(C)(C)C)C=7C=CC= CC7
ຮອຍຍິ້ມ Isomeric
C(OC[C@H]1O[C@H]([C@H](O[Si](C(C)(C)C)(C)C)[C@@H]1O)N2C= 3C(N=C2)=C(NC(=O)C4=CC=CC=C4)N=CN3)(C5=CC=C(OC)C=C5)(C6=CC=C(OC)C= C6)C7=CC=CC=C7
ອິນChI
InChI=1S/C44H49N5O7Si/c1-43(2,3)57(6,7)56-38-37(50)35(55-42(38)49-28-47-36-39(45-27- 46-40(36)49)48-41(51)29-14-10-8-11-15-2 9)26-54-44(30-16-12-9-13-17-30,31 -18-22-33(52-4)23-19-31)32-20-24-34(53-5)25-21-32/h8-25,27-28,35,37-38,42 ,50H,26H2,1-7H3,(H,
45,46,48,51)/t35-,37-,38-,42-/m1/s1
ລະຫັດ InChI
DAZIGOPASNJPCJ-GNECSJIWSA-N
2 ຊື່ອື່ນສໍາລັບສານນີ້
N-Benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-[(1,1-dimethylethyl)dimethylsilyl]adenosine (ACI);N6-Benzoyl-5′-O-(4,4′- dimethoxytrityl)-2′-O-(tert-butyldimethylsilyl)adenosine
ມີ Spectra
1H NMR
Hetero NMR
| ຄຸນສົມບັດທີ່ມີຢູ່ |
| ຊີວະວິທະຍາ |
| ເຄມີ |
| ຄວາມຫນາແຫນ້ນ |
| ລິບສະກີ |
| ໂຄງສ້າງທີ່ກ່ຽວຂ້ອງ |
ຊີວະວິທະຍາ
| ຄຸນສົມບັດ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 1.00 x 106 | pH 1;ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 1.00 x 106 | pH 2;ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 1.00 x 106 | pH 3;ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 1.00 x 106 | pH 4;ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 1.00 x 106 | pH 5;ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 1.00 x 106 | pH 6;ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 1.00 x 106 | pH 7;ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 1.00 x 106 | pH 8;ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 1.00 x 106 | pH 9;ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 5.41 x 105 | pH 10;ອຸນຫະພູມ: 25°C | (1) ACD |
(1) ການຄິດໄລ່ໂດຍໃຊ້ Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
ເຄມີ
| ຄຸນສົມບັດ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| ກຄ | 2.01 x 106 | pH 1;ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 6.87 x 106 | pH 2;ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 9.08 x 106 | pH 3;ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 9.38 x 106 | pH 4;ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 9.39 x 106 | pH 5;ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 9.19 x 106 | pH 6;ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 7.53 x 106 | pH 7;ອຸນຫະພູມ: 25°C | (1) ACD |
| ຄຸນສົມບັດ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| ກຄ | 2.73 x 106 | pH 8;ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 4.48 x 105 | pH 9;ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 1.31 x 105 | pH 10;ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 9.62 | pH 1;ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 10.15 | pH 2;ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 10.27 | pH 3;ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 10.29 | pH 4;ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 10.29 | pH 5;ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 10.28 | pH 6;ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 10.19 | pH 7;ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 9.75 | pH 8;ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 8.97 | pH 9;ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 8.43 | pH 10;ອຸນຫະພູມ: 25°C | (1) ACD |
| logP | 10.291±0.708 | ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍພາຍໃນມະຫາຊົນ | 1.1 x 10-6 g/L | ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 4.8 x 10-6 g/L | pH 1;ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.4 x 10-6 g/L | pH 2;ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.1 x 10-6 g/L | pH 3;ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.0 x 10-6 g/L | pH 4;ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.0 x 10-6 g/L | pH 5;ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.0 x 10-6 g/L | pH 6;ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.3 x 10-6 g/L | pH 7;ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 3.5 x 10-6 g/L | pH 8;ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 2.2 x 10-5 g/L | pH 9;ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 7.6 x 10-5 g/L | pH 10;ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.3 x 10-6 g/L | Unbuffered Water pH 7.00;ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar Intrinsic Solubility | 1.4 x 10-9 mol/L | ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 6.1 x 10-9 mol/L | pH 1;ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 1.8 x 10-9 mol/L | pH 2;ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 1.4 x 10-9 mol/L | pH 3;ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 1.3 x 10-9 mol/L | pH 4;ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 1.3 x 10-9 mol/L | pH 5;ອຸນຫະພູມ: 25°C | (1) ACD |
| ຄຸນສົມບັດ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| Molar solubility | 1.3 x 10-9 mol/L | pH 6;ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 1.6 x 10-9 mol/L | pH 7;ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 4.5 x 10-9 mol/L | pH 8;ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 2.8 x 10-8 mol/L | pH 9;ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 9.6 x 10-8 mol/L | pH 10;ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 1.6 x 10-9 mol/L | Unbuffered Water pH 7.00;ອຸນຫະພູມ: 25°C | (1) ACD |
| ນ້ຳໜັກໂມເລກຸນ | 787.98 | ||
| pKa | 7.87±0.43 | ອຸນຫະພູມອາຊິດຫຼາຍທີ່ສຸດ: 25 °C | (1) ACD |
| pKa | 1.39±0.10 | ອຸນຫະພູມຕ່ຳສຸດ: 25°C | (1) ACD |
(1) ການຄິດໄລ່ໂດຍໃຊ້ Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
ຄວາມຫນາແຫນ້ນ
| ຄຸນສົມບັດ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| ຄວາມຫນາແຫນ້ນ | 1.23±0.1 g/cm3 | ອຸນຫະພູມ: 20 °C;ກົດ: 760 Torr | (1) ACD |
| ປະລິມານ Molar | 639.5±7.0 cm3/mol | ອຸນຫະພູມ: 20 °C;ກົດ: 760 Torr | (1) ACD |
(1) ການຄິດໄລ່ໂດຍໃຊ້ Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
ລິບສະກີ
| ຄຸນສົມບັດ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| ພັນທະບັດທີ່ສາມາດຫມຸນໄດ້ຢ່າງເສລີ | 14 | (1) ACD | |
| H ຜູ້ຮັບ | 12 | (1) ACD | |
| H ຜູ້ໃຫ້ທຶນ | 2 | (1) ACD | |
| H ຜູ້ໃຫ້ທຶນ/ຍອດຜູ້ຮັບ | 14 | (1) ACD | |
| logP | 10.291±0.708 | ອຸນຫະພູມ: 25°C | (1) ACD |
| ນ້ຳໜັກໂມເລກຸນ | 787.98 |
(1) ການຄິດໄລ່ໂດຍໃຊ້ Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
ໂຄງສ້າງທີ່ກ່ຽວຂ້ອງ
| ຄຸນສົມບັດ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| ພື້ນທີ່ຂົ້ວໂລກ | 139 A2 | (1) ACD | |
(1) ການຄິດໄລ່ໂດຍໃຊ້ Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
ມີ Spectra
1H NMR
13C NMR
![C48H54N7O8P Adenosine, N-benzoyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – O-methyl-, 3′ – [2-cyanoethyl N, N-bis(1-methylethyl)phosphor amidite] (ACI)](https://cdn.globalso.com/nvchem/C48H54N7O8P-300x300.png)
![C50H58N7O9P Adenosine, N-benzoyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – O-(2-methoxyethyl)-, 3′– [2-cyanoethyl N, N-bis(1-methylethyl) phosphoramide] (ACI)](https://cdn.globalso.com/nvchem/C50H58N7O9P-Adenosine-300x300.png)
![C10H12N2O5 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-6-one, 2,3,3a,9a-tetrah ydro-3-hydroxy-2-(hydroxymethyl)- 7-methyl-, (2R,3 R,3aS,9aR)- (9CI, ACI)](https://cdn.globalso.com/nvchem/C10H12N2O5-6H-Furo-300x300.jpg)
![C31H32N2O8 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyl- (9C I, ACI)](https://cdn.globalso.com/nvchem/C31H32N2O8-Uridine-300x300.jpg)
