计算溶液所需的质量、体积或浓度。
活性类型 | 活性值-log(M) | 作用机制 | 期刊 | 参考文献(PubMed IDs) |
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货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
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H614035-5mg |
5mg |
期货 ![]() |
| |
H614035-25mg |
25mg |
期货 ![]() |
|
别名 | [³H]17β-雌二醇 |
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英文别名 | 3,17-Epidihydroxyestratriene | Estraderm TTS 50 | Dihydromenformon | Compudose 365 | Dihydroxyesterin | Estrace | Primofol | B-Estradiol | Estrogens, esterified | Oestergon | Ovastevol | Alora | Corpagen | Syndiol | 17b-Oestradiol | Gynodiol | Dihydrofoll |
规格或纯度 | Moligand™ |
英文名称 | [³H]17β-estradiol |
作用类型 | 激动剂 |
作用机制 | 雌激素受体α激动剂 |
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作用机制 | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | 参考文献 |
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分子类型 | 小分子 |
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IUPAC Name | (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol |
INCHI | InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1 |
InChi Key | VOXZDWNPVJITMN-ZBRFXRBCSA-N |
Canonical SMILES | Oc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2O)C |
Isomeric SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O |
PubChem CID | 5757 |
分子量 | 272.400 g/mol |
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XLogP3 | 4.000 |
氢键供体数Hydrogen Bond Donor Count | 2 |
氢键受体数Hydrogen Bond Acceptor Count | 2 |
可旋转键计数Rotatable Bond Count | 0 |
精确质量Exact Mass | 272.178 Da |
单同位素质量Monoisotopic Mass | 272.178 Da |
拓扑极表面积Topological Polar Surface Area | 40.500 Ų |
重原子数Heavy Atom Count | 20 |
形式电荷Formal Charge | 0 |
复杂度Complexity | 382.000 |
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 | 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 |