basic_info |
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Product_Name: | OXYACANTHINE DIHYDROCHLORIDE |
EnglishSynonyms: | OXYACANTHINE DIHYDROCHLORIDE |
pro_mdlNumber: | MFCD00238655 |
pro_acceptors: | 8 |
pro_donors: | 1 |
pro_smile: | CN1CCc2cc(c3cc2[C@H]1Cc4ccc(c(c4)Oc5ccc(cc5)C[C@H]6c7c(cc(c(c7O3)OC)OC)CCN6C)O)OC.Cl.Cl |
InChi: | InChI=1S/C37H40N2O6.2ClH/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)17-23-8-11-30(40)31(18-23)44-26-9-6-22(7-10-26)16-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33;;/h6-11,18-21,28-29,40H,12-17H2,1-5H3;2*1H/t28-,29+;;/m1../s1 |
InChiKey: | InChIKey=CJTFLIHOOZSHBJ-WIFSAEPPSA-N |
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