| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| D110212-5mg |
5mg |
现货  |
| |
| D110212-20mg |
20mg |
现货 |
|
| 英文别名 | DEHYDROANDROGRAPHOLIDESUCCINATE | 4-(((1R,2R,4aR,5R,8aS)-2-((3-Carboxypropanoyl)oxy)-1,4a-dimethyl-6-methylene-5-((E)-2-(2-oxo-2,5-dihydrofuran-3-yl)vinyl)decahydronaphthalen-1-yl)methoxy)-4-oxobutanoic acid | 14-DEOXY-11,12-DEHYDROANDROGRAPHOLIDE SUCCINA |
|---|---|
| 规格或纯度 | 分析标准品, ≥99% |
| 英文名称 | Dehydroandrographolide succinate |
| 运输条件 | 常规运输 |
| 纯度 | ≥99% |
| 分子类型 | 小分子 |
|---|---|
| IIUPAC Name | 4-[[(1R,2R,4aR,5R,8aS)-2-(3-carboxypropanoyloxy)-1,4a-dimethyl-6-methylidene-5-[(E)-2-(5-oxo-2H-furan-4-yl)ethenyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-4-oxobutanoic acid |
| INCHI | 1S/C28H36O10/c1-17-4-7-20-27(2,19(17)6-5-18-13-15-36-26(18)35)14-12-21(38-25(34)11-9-23(31)32)28(20,3)16-37-24(33)10-8-22(29)30/h5-6,13,19-21H,1,4,7-12,14-16H2,2-3H3,(H,29,30)(H,31,32)/b6-5+/t19-,20+,21-,27+,28+/m1/s1 |
| InChi Key | YTHKMAIVPFVDNU-GPTWTFMPSA-N |
| Smiles | CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)COC(=O)CCC(=O)O)OC(=O)CCC(=O)O |
| Isomeric SMILES | C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)[C@H]2/C=C/C3=CCOC3=O)(C)COC(=O)CCC(=O)O)OC(=O)CCC(=O)O |
| PubChem CID | 6540717 |
| 分子量 | 532.58 |
| 密度 | 1.29 |
|---|---|
| 分子量 | 532.600 g/mol |
| XLogP3 | 2.700 |
| 氢键供体数Hydrogen Bond Donor Count | 2 |
| 氢键受体数Hydrogen Bond Acceptor Count | 10 |
| 可旋转键计数Rotatable Bond Count | 13 |
| 精确质量Exact Mass | 532.231 Da |
| 单同位素质量Monoisotopic Mass | 532.231 Da |
| 拓扑极表面积Topological Polar Surface Area | 154.000 Ų |
| 重原子数Heavy Atom Count | 38 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 1060.000 |
| 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 | 5 |
| 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 | 1 |
| 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 | 1 |
| 共价键合单元计数Covalently-Bonded Unit Count | 1 |
| 1. Yang Zhitao, Wang Shan, Wang Shijie, Han Sijia, Wei Lingzui, Yang Wenlong. (2024) Detection of doxycycline by using a tapered droplet structure fiber sensor. REVIEW OF SCIENTIFIC INSTRUMENTS, 95 (3): [PMID:38477656] [10.1063/5.0164105] |
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