基本信息 |
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| 产品名称： | EMOLECULES 30176219 |
| 英文同义词： | EMOLECULES 30176219 |
| MDL号： | MFCD16885407 |
| 氢键受体数量： | 3 |
| 氢键供体数量： | 1 |
| Smile： | CC(C)C(CN)c1ccc(c(c1)OC)OC.C(=O)(C(=O)O)O |
| InChi： | InChI=1S/C13H21NO2.C2H2O4/c1-9(2)11(8-14)10-5-6-12(15-3)13(7-10)16-4;3-1(4)2(5)6/h5-7,9,11H,8,14H2,1-4H3;(H,3,4)(H,5,6) |
| InChiKey： | InChIKey=IWQAPHGPMKKESP-UHFFFAOYSA-N |
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