basic_info |
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Product_Name: | JASPAMIDE |
CAS: | 102396-24-7 |
EnglishSynonyms: | JASPLAKINOLIDE (+) ; JASPAMIDE |
pro_mdlNumber: | MFCD00873735 |
pro_acceptors: | 10 |
pro_donors: | 4 |
pro_smile: | C[C@@H]\1C[C@@H](OC(=O)C[C@@H](NC(=O)[C@H](N(C(=O)[C@@H](NC(=O)[C@H](C/C(=C1)/C)C)C)C)Cc2c3ccccc3[nH]c2Br)c4ccc(cc4)O)C |
InChi: | InChI=1S/C36H45BrN4O6/c1-20-15-21(2)17-23(4)47-32(43)19-30(25-11-13-26(42)14-12-25)40-35(45)31(18-28-27-9-7-8-10-29(27)39-33(28)37)41(6)36(46)24(5)38-34(44)22(3)16-20/h7-15,21-24,30-31,39,42H,16-19H2,1-6H3,(H,38,44)(H,40,45)/b20-15+/t21-,22-,23-,24-,30+,31+/m0/s1 |
InChiKey: | InChIKey=GQWYWHOHRVVHAP-DHKPLNAMSA-N |
property |
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secure_info |
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secure_wgk_germany: | 3 |
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