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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E423618-1ml |
1ml |
现货 ![]() |
|
英文别名 | Adenosine-5'-(N-ethylcarboxamide) | Adenosine-5-(N-ethylcarboxamide) | (2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide | N-Ethylcarboxamidoadenosine | MS-24461 | AC-27392 | beta-D-Ribofuranuronamide, 1-(6-amino-9H-purin-9-yl |
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规格或纯度 | Moligand™, 10mM in DMSO |
英文名称 | 5’-EthylcarboxamidoAdenosine |
生化机理 | 高亲和力腺苷受体激动剂(人A3,A1和A2A受体的Ki值分别为6.2、14和20 nM;人A2B的EC50 =2.4μM)。抑制血小板聚集,并在体内具有中心活性。 |
储存温度 | -80℃储存 |
运输条件 | 超低温冰袋运输 |
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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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EC号 | 636-060-5, 636-863-0 |
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分子类型 | 小分子 |
IUPAC Name | (2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide |
INCHI | InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1 |
InChi Key | JADDQZYHOWSFJD-FLNNQWSLSA-N |
Canonical SMILES | CCNC(=O)C1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O |
Isomeric SMILES | CCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O |
WGK Germany | 3 |
RTECS | VJ2232000 |
关联CAS | 78647-50-4,35920-39-9 |
MeSH Entry Terms | 5' N Ethylcarboxamidoadenosine;5'-N-Ethylcarboxamidoadenosine;Adenosine 5' N ethyluronamide;Adenosine, N6-Ethyl-carboxamido;Adenosine-5'-(N-ethylcarboxamide);Adenosine-5'-N-ethyluronamide;N Ethylcarboxamidoadenosine;N-Ethylcarboxamidoadenosine;N6 Ethyl ca |
分子量 | 308.3 |
Reaxy-Rn | 24735871 |
Reaxys-RN link address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=24735871&ln= |
分子量 | 308.290 g/mol |
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XLogP3 | -0.700 |
氢键供体数Hydrogen Bond Donor Count | 4 |
氢键受体数Hydrogen Bond Acceptor Count | 8 |
可旋转键计数Rotatable Bond Count | 3 |
精确质量Exact Mass | 308.123 Da |
单同位素质量Monoisotopic Mass | 308.123 Da |
拓扑极表面积Topological Polar Surface Area | 148.000 Ų |
重原子数Heavy Atom Count | 22 |
形式电荷Formal Charge | 0 |
复杂度Complexity | 426.000 |
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 | 4 |
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 | GHS06 |
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信号词 | Danger |
危险声明 |
H300: 吞咽致命 |
预防措施声明 |
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。 P270: 使用本产品时,请勿进食、饮水或吸烟。 P330: 漱口 P301+P316: 如果吞咽:立即寻求紧急医疗救助。 |
WGK Germany | 3 |
RTECS | VJ2232000 |
Reaxy-Rn | 24735871 |
Reaxys-RN link address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=24735871&ln= |
个人防护装备 | Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges |
concentration | 9.0-11.0(mmol/L) |
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NMR Spectrum 1H | conforms to structure |