奧瑪環(huán)素雜質(zhì)13 基本信息
| 中文名稱 | 奧瑪環(huán)素雜質(zhì)13 |
|---|---|
| 中文同義詞 | 羥甲基奧馬環(huán)素;奧馬環(huán)素雜質(zhì)03;奧馬環(huán)素雜質(zhì)3;奧馬環(huán)素雜質(zhì)32;奧馬環(huán)素M-2雜質(zhì);奧馬環(huán)素甲酰胺雜質(zhì)對照品;戈舍瑞林 EP 雜質(zhì) I 三氟乙酸酯;奧瑪環(huán)素雜質(zhì)13 |
| 英文名稱 | Omadacycline Impurity 13 |
| 英文同義詞 | Omadacycline Impurity 13;(4S,4aS,5aR,12aS)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-N-(hydroxymethyl)-9-((neopentylamino)methyl)-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide;hydroxymethylomacycline;Hydroxymethyl Omadacycline;2-Naphthacenecarboxamide, 4,7-bis(dimethylamino)-9-[[(2,2-dimethylpropyl)amino]methyl]-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-N-(hydroxymethyl)-1,11-dioxo-, (4S,4aS,5aR,12aS)-;Omadacycline Impurity 3;Omacycline impurity 32;Omadacycline M-2 Impurity |
| CAS號 | 1075240-42-4 |
| 分子式 | C30H42N4O8 |
| 分子量 | 586.68 |
| EINECS號 | |
| 相關(guān)類別 | |
| Mol文件 | 1075240-42-4.mol |
| 結(jié)構(gòu)式 |  |
奧瑪環(huán)素雜質(zhì)13 性質(zhì)
| 沸點 | 875.2±65.0 °C(predicted) |
|---|---|
| 密度 | 1.41±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted) |
| 酸度系數(shù)(pKa) | 4.50±1.00(predicted) |
| InChIKey | UYJXPAQXVWETSI-YJUULGSPSA-N |
| SMILES | O[C@@]12C(C(=C([C@H]([C@]1([H])C[C@]1([H])CC3=C(C=C(C(=C3C(C1=C2O)=O)O)CNCC(C)(C)C)N(C)C)N(C)C)O)C(=O)NCO)=O |