| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| M426112-1ml |
1ml |
现货  |
|
| 别名 | α-酮亮氨酸 |
|---|---|
| 英文别名 | 2-keto-4-methyl-pentanoate | 2-oxo-4-methylpentanoate | 2-Oxo-4-methylvaleric acid | NCGC00246997-01 | D82408 | Isopropylpyruvic acid | STR07443 | HY-W012722 | UNII-4GUJ8AH400 | a-Ketoisocapronate | 2-Keto-4-methylpentanoic acid | 4-Methyl-2-oxovaleric ac |
| 规格或纯度 | Moligand™, 10mM in DMSO |
| 英文名称 | 4-Methyl-2-oxovaleric acid |
| 储存温度 | -80℃储存 |
| 运输条件 | 超低温冰袋运输 |
| 产品介绍 |
酮亮氨酸钙的中间体。 An intermediate in the metabolism of leucine. |
| 作用机制 | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | 参考文献 |
|---|
| EC号 | 212-435-5 |
|---|---|
| 分子类型 | 小分子 |
| IUPAC Name | 4-methyl-2-oxopentanoic acid |
| INCHI | InChI=1S/C6H10O3/c1-4(2)3-5(7)6(8)9/h4H,3H2,1-2H3,(H,8,9) |
| InChi Key | BKAJNAXTPSGJCU-UHFFFAOYSA-N |
| Canonical SMILES | CC(C)CC(=O)C(=O)O |
| Isomeric SMILES | CC(C)CC(=O)C(=O)O |
| WGK Germany | 3 |
| PubChem CID | 70 |
| UN Number | 3265 |
| 分子量 | 130.14 |
| Beilstein号 | 1701823 |
| Reaxy-Rn | 1701823 |
| 折光率 | 1.431 |
|---|---|
| 闪点(℃) | 83 °C |
| 沸点 | 85 °C |
| 熔点 | 8-10°C |
| 分子量 | 130.139 g/mol |
| XLogP3 | 0.900 |
| 氢键供体数Hydrogen Bond Donor Count | 1 |
| 氢键受体数Hydrogen Bond Acceptor Count | 3 |
| 可旋转键计数Rotatable Bond Count | 3 |
| 精确质量Exact Mass | 130.063 Da |
| 单同位素质量Monoisotopic Mass | 130.063 Da |
| 拓扑极表面积Topological Polar Surface Area | 54.400 Ų |
| 重原子数Heavy Atom Count | 9 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 126.000 |
| 同位素原子数Isotope Atom Count | 0 |
| 定义的原子立体中心计数Defined Atom Stereocenter Count | 0 |
| 未定义的原子立体中心计数Undefined Atom Stereocenter Count | 0 |
| 定义的键立体中心计数Defined Bond Stereocenter Count | 0 |
| 未定义的键立体中心计数Undefined Bond Stereocenter Count | 0 |
| 所有立体化学键的总数The total count of all stereochemical bonds | 0 |
| 共价键合单元计数Covalently-Bonded Unit Count | 1 |
| 象形图 | GHS05 |
|---|---|
| 信号词 | Danger |
| 危险声明 |
H314: 造成严重的皮肤灼伤和眼睛损伤 |
| 预防措施声明 |
P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。 P321: 特殊处理（请参阅此标签上的...）。 P405: 密闭存放 P501: 将内容物/容器处理到。。。 P264: 处理后要彻底洗手。 P260: 不要吸入灰尘/烟雾/气体/雾/蒸汽/喷雾。 P301+P330+P331: 如误吞咽：漱口。不要诱导呕吐。 P304+P340: 如误吸入：将人转移到空气新鲜处，保持呼吸舒适体位。 P363: 再次使用之前，请清洗受污染的衣物。 P305+P354+P338: 如果进入眼睛：立即用水冲洗几分钟。取下隐形眼镜（如果有的话），并且操作简单。继续冲洗。 P302+P361+P354: 如果接触皮肤：立即脱掉所有被污染的衣服。立即用水冲洗几分钟。 P316: 立即寻求紧急医疗救助。 |
| WGK Germany | 3 |
| Reaxy-Rn | 1701823 |
| 个人防护装备 | Faceshields,full-face respirator (US),Gloves,Goggles,multi-purpose combination respirator cartridge (US),type ABEK (EN14387) respirator filter |
| Concentration(Compounding value) | 9.0-11.0(mmol/L) |
|---|---|
| Appearance(Colorless Transparent Liquid) | Pass |
| Record the entire process by video | Conform |
| 1. Xinjian Yin, Yayun Liu, Lijun Meng, Haisheng Zhou, Jianping Wu, Lirong Yang. (2020) Semi-rational hinge engineering: modulating the conformational transformation of glutamate dehydrogenase for enhanced reductive amination activity towards non-natural substrates. Catalysis Science & Technology, 10 (10): (3376-3386). [10.1039/C9CY02576F] |
| 2. Xinjian Yin, Yayun Liu, Lijun Meng, Haisheng Zhou, Jianping Wu, Lirong Yang. (2018) Rational Molecular Engineering of Glutamate Dehydrogenases for Enhancing Asymmetric Reductive Amination of Bulky α-Keto Acids. ADVANCED SYNTHESIS & CATALYSIS, 361 (4): (803-812). [10.1002/adsc.201801251] |
| 1. Xinjian Yin, Yayun Liu, Lijun Meng, Haisheng Zhou, Jianping Wu, Lirong Yang. (2020) Semi-rational hinge engineering: modulating the conformational transformation of glutamate dehydrogenase for enhanced reductive amination activity towards non-natural substrates. Catalysis Science & Technology, 10 (10): (3376-3386). [10.1039/C9CY02576F] |
| 2. Xinjian Yin, Yayun Liu, Lijun Meng, Haisheng Zhou, Jianping Wu, Lirong Yang. (2018) Rational Molecular Engineering of Glutamate Dehydrogenases for Enhancing Asymmetric Reductive Amination of Bulky α-Keto Acids. ADVANCED SYNTHESIS & CATALYSIS, 361 (4): (803-812). [10.1002/adsc.201801251] |
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