![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) ຮູບພາບເດັ່ນ](https://cdn.globalso.com/nvchem/C33H35N3O8-Cytidine.jpg)
C33H35N3O8 Cytidine, N-acetyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O- methyl- (9CI, ACI)
| ຄຸນສົມບັດທາງກາຍະພາບທີ່ສໍາຄັນ | ມູນຄ່າ | ສະພາບ |
| ນ້ຳໜັກໂມເລກຸນ | 601.65 | - |
| ຄວາມໜາແໜ້ນ (ຄາດຄະເນ) | 1.28±0.1 g/cm3 | ອຸນຫະພູມ: 20 °C; ກົດ: 760 Torr |
| pKa (ຄາດຄະເນ) | 10.19±0.20 | ອຸນຫະພູມອາຊິດຫຼາຍທີ່ສຸດ: 25 °C |
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 smile C(OC[C@H]1O[C@H]([C@H](OC)[C@@H]1O)N2C(=O)N=C(NC(C)=O)C =C2)(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
ອິນChI
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-/m1/s1
ລະຫັດ InChI
FINUHOJILDNELQ-PMFUCWTESA-N
1 ຊື່ອື່ນສໍາລັບສານນີ້
N-Acetyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methylcytidine (ACI)
| ຄຸນສົມບັດທີ່ມີຢູ່ |
| ຊີວະວິທະຍາ |
| ເຄມີ |
| ຄວາມຫນາແຫນ້ນ |
| ລິບສະກີ |
| ໂຄງສ້າງທີ່ກ່ຽວຂ້ອງ |
ຊີວະວິທະຍາ
| ຊັບສິນ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 8.87 | pH 1; ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 27.8 | pH 2; ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | ໑໗໑ | pH 3; ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 515 | pH 4; ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 650 | pH 5; ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 668 | pH 6; ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 668 | pH 7; ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 657 | pH 8; ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 560 | pH 9; ອຸນຫະພູມ: 25°C | (1) ACD |
| ປັດໄຈຄວາມເຂັ້ມຂົ້ນຂອງຊີວະພາບ | 229 | pH 10; ອຸນຫະພູມ: 25°C | (1) ACD |
(1) ການຄິດໄລ່ໂດຍໃຊ້ Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
ເຄມີ
| ຊັບສິນ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| ກຄ | 48.6 | pH 1; ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 152 | pH 2; ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 935 | pH 3; ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 2820 | pH 4; ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 3560 | pH 5; ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 3660 | pH 6; ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 3660 | pH 7; ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 3600 | pH 8; ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 3070 | pH 9; ອຸນຫະພູມ: 25°C | (1) ACD |
| ກຄ | 1250 | pH 10; ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 2.14 | pH 1; ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 2.64 | pH 2; ອຸນຫະພູມ: 25°C | (1) ACD |
| ຊັບສິນ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| logD | 3.43 | pH 3; ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 3.91 | pH 4; ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 4.01 | pH 5; ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 4.02 | pH 6; ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 4.02 | pH 7; ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 4.01 | pH 8; ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 3.94 | pH 9; ອຸນຫະພູມ: 25°C | (1) ACD |
| logD | 3.55 | pH 10; ອຸນຫະພູມ: 25°C | (1) ACD |
| logP | 4.021±0.768 | ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍພາຍໃນມະຫາຊົນ | 1.3 x 10-3 g/L | ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 0.10 g/L | pH 1; ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 0.032 g/L | pH 2; ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 5.2 x 10-3 g/L | pH 3; ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.7 x 10-3 g/L | pH 4; ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.4 x 10-3 g/L | pH 5; ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.3 x 10-3 g/L | pH 6; ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.3 x 10-3 g/L | pH 7; ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.3 x 10-3 g/L | pH 8; ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.6 x 10-3 g/L | pH 9; ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 3.9 x 10-3 g/L | pH 10; ອຸນຫະພູມ: 25°C | (1) ACD |
| ການລະລາຍມະຫາຊົນ | 1.3 x 10-3 g/L | Unbuffered Water pH 6.99; ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar Intrinsic Solubility | 2.2 x 10-6 mol/L | ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 1.7 x 10-4 mol/L | pH 1; ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 5.3 x 10-5 mol/L | pH 2; ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 8.6 x 10-6 mol/L | pH 3; ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 2.9 x 10-6 mol/L | pH 4; ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 2.3 x 10-6 mol/L | pH 5; ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 2.2 x 10-6 mol/L | pH 6; ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 2.2 x 10-6 mol/L | pH 7; ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 2.2 x 10-6 mol/L | pH 8; ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 2.6 x 10-6 mol/L | pH 9; ອຸນຫະພູມ: 25°C | (1) ACD |
| Molar solubility | 6.4 x 10-6 mol/L | pH 10; ອຸນຫະພູມ: 25°C | (1) ACD |
| ຊັບສິນ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| Molar solubility | 2.2 x 10-6 mol/L | Unbuffered Water pH 6.99; ອຸນຫະພູມ: 25°C | (1) ACD |
| ນ້ຳໜັກໂມເລກຸນ | 601.65 | ||
| pKa | 10.19±0.20 | ອຸນຫະພູມອາຊິດຫຼາຍທີ່ສຸດ: 25 °C | (1) ACD |
| pKa | 3.57±0.20 | ອຸນຫະພູມຕ່ຳສຸດ: 25°C | (1) ACD |
(1) ການຄິດໄລ່ໂດຍໃຊ້ Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
ຄວາມຫນາແຫນ້ນ
| ຊັບສິນ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| ຄວາມຫນາແຫນ້ນ | 1.28±0.1 g/cm3 | ອຸນຫະພູມ: 20 °C; ກົດ: 760 Torr | (1) ACD |
| ປະລິມານ Molar | 466.5±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
| ຊັບສິນ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| ພັນທະບັດທີ່ສາມາດຫມຸນໄດ້ຢ່າງເສລີ | 11 | (1) ACD | |
| H ຜູ້ຮັບ | 11 | (1) ACD | |
| H ຜູ້ໃຫ້ທຶນ | 2 | (1) ACD | |
| H ຜູ້ໃຫ້ທຶນ/ຍອດຜູ້ຮັບ | 13 | (1) ACD | |
| logP | 4.021±0.768 | ອຸນຫະພູມ: 25°C | (1) ACD |
| ນ້ຳໜັກໂມເລກຸນ | 601.65 |
(1) ການຄິດໄລ່ໂດຍໃຊ້ Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
ໂຄງສ້າງທີ່ກ່ຽວຂ້ອງ
| ຊັບສິນ | ມູນຄ່າ | ສະພາບ | ທີ່ມາ |
| ພື້ນທີ່ຂົ້ວໂລກ | 128 A2 | (1) ACD | |
(1) ການຄິດໄລ່ໂດຍໃຊ້ Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
ມີ Spectra
1H NMR
13C NMR
![C20H31NO5 ອາຊິດ Heptanoic, 3- hydroxy-5-methyl-4-[[(phenylmethoxy)carbonyl] amino]-, 1,1-dimethylethyl ester, [3R-(3R*,4S*,5S*)]- (9CI) H301](https://cdn.globalso.com/nvchem/C20H31NO5-Heptanoic-acid-300x300.jpg)
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![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)
![C31H30N2O7 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-6-one, 2-[[bis(4-methoxy phenyl)phenylmethoxy]methyl]-2,3,3a ,9a-tetrahydro-3-hydroxy-7- methyl-, (2R,3R,3aS,9aR)- (9CI, ACI)](https://cdn.globalso.com/nvchem/C31H30N2O7-6H-Furo-300x300.jpg)