2-[(4,6-diamino-3-{[3-amino-4,5-dihydroxy-6-(1-hydroxyethyl)oxan-2-yl]oxy}-2-hydroxycyclohexyl)oxy]-5-methyl-4-(methylamino)oxane-3,5-diol; bis(sulfuric acid)

• ChemBase编号: 105093
• 分子式: C20H44N4O18S2
• 平均质量: 692.70936
• 单一同位素质量: 692.20920259
• SMILES: CNC1C(O)C(OCC1(C)O)OC1C(N)CC(N)C(OC2OC(C(C)O)C(O)C(O)C2N)C1O.OS(=O)(=O)O.OS(=O)(=O)O
• Canonical SMILES: OS(=O)(=O)O.OS(=O)(=O)O.CNC1C(O)C(OCC1(C)O)OC1C(N)CC(C(C1O)OC1OC(C(O)C)C(C(C1N)O)O)N
• InChI: InChI=1S/C20H40N4O10.2H2O4S/c1-6(25)14-11(27)10(26)9(23)18(32-14)33-15-7(21)4-8(22)16(12(15)28)34-19-13(29)17(24-3)20(2,30)5-31-19;2*1-5(2,3)4/h6-19,24-30H,4-5,21-23H2,1-3H3;2*(H2,1,2,3,4)
• InChIKey: UHEPSJJJMTWUCP-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 2-[(4,6-diamino-3-{[3-amino-4,5-dihydroxy-6-(1-hydroxyethyl)oxan-2-yl]oxy}-2-hydroxycyclohexyl)oxy]-5-methyl-4-(methylamino)oxane-3,5-diol; bis(sulfuric acid)
• IUPAC传统名: antibiotic G418; bis(sulfuric acid)
• 别名: Antibiotic G418; GENETICIN® DISULFATE SALT

登记号

• CAS号: 108321-42-2
• PubChem SID: 162092252
• PubChem CID: 16760463

理论计算性质

• Acid pKa: 12.420779
• 质子受体: 14
• 质子供体: 10
• LogD (pH = 5.5): -16.208046
• LogD (pH = 7.4): -10.701025
• Log P: -5.3008466
• 摩尔折射率: 114.0036 cm^3
• 极化性: 48.22068 Å^3
• 极化表面积: 248.39 Å^2
• 可自由旋转的化学键: 6
• 里宾斯基五规则: false

分子性质

安全信息

• 保存条件: 2-8°C

产品相关信息

• 纯度: ~98%

详细说明

MP Biomedicals - 02158782

Cell Culture Grade
Disulfate Salt
Purity: ~98%
Geneticin is an aminoglycoside related to Gentamicin and is toxic to bacteria, yeast, higher plants, mammalian cells, protozoans and helminths. The resistance genes are located on transposons Tn601(903) & Tn5 and are bacterial in derivation, but they can be expressed in eucaryotic cells. By introducing these genes into cells, resistance to Geneticin is conferred. Potency: > 450μg/mg.Geneticin™ is a registered trademark of Life Technologies, Inc.