basic_info |
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| Product_Name: | BRUCEINE E |
| CAS: | 21586-90-3 |
| EnglishSynonyms: | BRUCEINE E |
| pro_mdlNumber: | MFCD00221754 |
| pro_acceptors: | 9 |
| pro_donors: | 6 |
| pro_smile: | CC1=C[C@@H]([C@H]([C@]2([C@H]1C[C@@H]3[C@]45C2[C@H]([C@@H]([C@]([C@@]4([C@H](C(=O)O3)O)O)(OC5)C)O)O)C)O)O |
| InChi: | InChI=1S/C20H28O9/c1-7-4-9(21)13(23)17(2)8(7)5-10-19-6-28-18(3,14(24)11(22)12(17)19)20(19,27)15(25)16(26)29-10/h4,8-15,21-25,27H,5-6H2,1-3H3/t8-,9-,10+,11+,12?,13+,14-,15-,17-,18+,19+,20+/m0/s1 |
| InChiKey: | InChIKey=ZBXITHPYBBXZRG-SLOOGWPFSA-N |
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secure_info |
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