C33h35n3O3 cytidine, n-acetyll-5'-o- [bis (4ci, ac)
ʻO nā waiwai pilikino | Waiwai | Kauoha |
Kaupaona molebular | 601.65 | - |
Density (wānana) | 1.28 ± 0.1 g / cm3 | Temp: 20 ° C; E kaomi: 760 Torr |
PKA (wānana) | 10.19 ± 0.20 | Nui loa acidic temp: 25 ° C |
Canonical smiles o = c1n = c = cn1c2oc (cc = c (c
Isomeric SMILES 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
Iachi
Inchi = 1s / c333h35n3_28 (32-3-19-25 15-11-23) 24-12-16-16 (41-3) 17-13-24 / H5-4-19-.4-.2-19-.27,3-.-S1
Inchi kī
Finuhojildenc-pmfucwtesA-n
1 inoa inoa no kēia mea
N-Acetyl-5'-O- [BIS (4-MetboxyPhenyl) PhenylMyticel] -2'-Oth)
Loaʻa nā waiwai |
Loea |
Kekau |
Huakai |
Lipinski |
Pili pū ka piliʻana |
Loea
Waiwai | Waiwai | Kauoha | Kumu |
Pūnaehana Pūnaewele | 8.87 | pH 1; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 27.8 | PH 2; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 171 | pH 3; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 515 | PH 4; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 650 | pH 5; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 668 | ph 6; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 668 | ph 7; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 657 | pH 8; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 560 | pH 9; Temp: 25 ° C | (1) acd |
Pūnaehana Pūnaewele | 229 | PH 10; Temp: 25 ° C | (1) acd |
(1) heluʻia me ka hoʻohanaʻana i ka hoʻomohalaʻana i ka lāʻau lapaʻau
Kekau
Waiwai | Waiwai | Kauoha | Kumu |
Koc | 48.6 | pH 1; Temp: 25 ° C | (1) acd |
Koc | 152 | PH 2; Temp: 25 ° C | (1) acd |
Koc | 935 | pH 3; Temp: 25 ° C | (1) acd |
Koc | 2820 | PH 4; Temp: 25 ° C | (1) acd |
Koc | 3560 | pH 5; Temp: 25 ° C | (1) acd |
Koc | He 3660 | ph 6; Temp: 25 ° C | (1) acd |
Koc | He 3660 | ph 7; Temp: 25 ° C | (1) acd |
Koc | 3600 | pH 8; Temp: 25 ° C | (1) acd |
Koc | 3070 | pH 9; Temp: 25 ° C | (1) acd |
Koc | 1250 | PH 10; Temp: 25 ° C | (1) acd |
Kākau | 2.14 | pH 1; Temp: 25 ° C | (1) acd |
Kākau | 2.64 | PH 2; Temp: 25 ° C | (1) acd |
Waiwai | Waiwai | Kauoha | Kumu |
Kākau | 3.43 | pH 3; Temp: 25 ° C | (1) acd |
Kākau | 3.91 | PH 4; Temp: 25 ° C | (1) acd |
Kākau | 4.01 | pH 5; Temp: 25 ° C | (1) acd |
Kākau | 4.02 | ph 6; Temp: 25 ° C | (1) acd |
Kākau | 4.02 | ph 7; Temp: 25 ° C | (1) acd |
Kākau | 4.01 | pH 8; Temp: 25 ° C | (1) acd |
Kākau | 3.94 | pH 9; Temp: 25 ° C | (1) acd |
Kākau | 3.55 | PH 10; Temp: 25 ° C | (1) acd |
LOGP | 4.021 ± 0.768 | Temp: 25 ° C | (1) acd |
ʻO ka solubilitic intrinsic | 1.3 x 10-3 g / l | Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 0.10 g / l | pH 1; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 0,032 g / l | PH 2; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 5.2 x 10-3 g / l | pH 3; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 1.7 x 10-3 g / l | PH 4; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 1.4 x 10-3 g / l | pH 5; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 1.3 x 10-3 g / l | ph 6; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 1.3 x 10-3 g / l | ph 7; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 1.3 x 10-3 g / l | pH 8; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 1.6 x 10-3 g / l | pH 9; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 3.9 x 10-3 g / l | PH 10; Temp: 25 ° C | (1) acd |
ʻO ka hopena nui | 1.3 x 10-3 g / l | ʻO ka wai whraffered wai ph 6.99; Temp: 25 ° C | (1) acd |
Molala intrinsic repubility | 2.2 x 10-6 mol / l | Temp: 25 ° C | (1) acd |
Mlagerliility | 1.7 x 10-4 mol / l | pH 1; Temp: 25 ° C | (1) acd |
Mlagerliility | 5.3 x 10-5 mol / l | PH 2; Temp: 25 ° C | (1) acd |
Mlagerliility | 8.6 x 10-6 mol / l | pH 3; Temp: 25 ° C | (1) acd |
Mlagerliility | 2.9 x 10-6 mol / l | PH 4; Temp: 25 ° C | (1) acd |
Mlagerliility | 2.3 x 10-6 mol / l | pH 5; Temp: 25 ° C | (1) acd |
Mlagerliility | 2.2 x 10-6 mol / l | ph 6; Temp: 25 ° C | (1) acd |
Mlagerliility | 2.2 x 10-6 mol / l | ph 7; Temp: 25 ° C | (1) acd |
Mlagerliility | 2.2 x 10-6 mol / l | pH 8; Temp: 25 ° C | (1) acd |
Mlagerliility | 2.6 x 10-6 mol / l | pH 9; Temp: 25 ° C | (1) acd |
Mlagerliility | 6.4 x 10-6 mol / l | PH 10; Temp: 25 ° C | (1) acd |
Waiwai | Waiwai | Kauoha | Kumu |
Mlagerliility | 2.2 x 10-6 mol / l | ʻO ka wai whraffered wai ph 6.99; Temp: 25 ° C | (1) acd |
Kaupaona molebular | 601.65 | ||
pka | 10.19 ± 0.20 | Nui loa acidic temp: 25 ° C | (1) acd |
pka | 3.57 ± 0.20 | ʻO ka hapa nui o ka temp: 25 ° C | (1) acd |
(1) heluʻia me ka hoʻohanaʻana i ka hoʻomohalaʻana i ka lāʻau lapaʻau
Huakai
Waiwai | Waiwai | Kauoha | Kumu |
Huakai | 1.28 ± 0.1 g / cm3 | Temp: 20 ° C; E kaomi: 760 Torr | (1) acd |
Mlar lang | 466.5 ± 7.0 cm3 / mol | Temp: 20 ° C; E kaomi: 760 Torr | (1) acd |
(1) heluʻia me ka hoʻohanaʻana i ka hoʻomohalaʻana i ka lāʻau lapaʻau
Lipinski
Waiwai | Waiwai | Kauoha | Kumu |
Nā mea paʻa paʻa | 11 | (1) acd | |
Hcceptors | 11 | (1) acd | |
H donors | 2 | (1) acd | |
H hāʻawi /ʻaeʻia ka loaʻa kālā | 13 | (1) acd | |
LOGP | 4.021 ± 0.768 | Temp: 25 ° C | (1) acd |
Kaupaona molebular | 601.65 |
(1) heluʻia me ka hoʻohanaʻana i ka hoʻomohalaʻana i ka lāʻau lapaʻau
Pili pū ka piliʻana
Waiwai | Waiwai | Kauoha | Kumu |
Wahi wahi papa | 128 a2 | (1) acd |
(1) heluʻia me ka hoʻohanaʻana i ka hoʻomohalaʻana i ka lāʻau lapaʻau
Specpe i Loa
1H NMR
13c nmr