basic_info |
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Product_Name: | 脱水穿心莲内酯 |
CAS: | 134418-28-3 |
中文同义词: | 脱水穿心莲内酯 |
EnglishSynonyms: | (3E)-3-[2-[(1S,4AS,5R,6R,8AS)-DECAHYDRO-6-HYDROXY-5-(HYDROXYMETHYL)-5,8A-DIMETHYL-2-METHYLENE-1-NAPHTHALENYL]ETHYLIDENE]-2(3H)-FURANONE ; DEHYDROANDROGRAPHOLIDE |
pro_mdlNumber: | MFCD17214349 |
pro_acceptors: | 4 |
pro_donors: | 2 |
pro_smile: | C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)[C@@H]2C/C=C/3\C=COC3=O)(C)CO)O |
InChi: | InChI=1S/C20H28O4/c1-13-4-7-16-19(2,10-8-17(22)20(16,3)12-21)15(13)6-5-14-9-11-24-18(14)23/h5,9,11,15-17,21-22H,1,4,6-8,10,12H2,2-3H3/b14-5+/t15-,16-,17+,19-,20-/m0/s1 |
InChiKey: | InChIKey=YIIRVUDGRKEWBV-CZUXAOBFSA-N |
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