基本信息 |
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产品名称: | 苯甲酰新乌头原碱 |
CAS: | 63238-67-5 |
中文同义词: | 苯甲酰新乌头原碱 |
英文同义词: | BENZOYLMESACONINE |
MDL号: | MFCD01673475 |
氢键受体数量: | 11 |
氢键供体数量: | 4 |
Smile: | CN1C[C@@]2([C@@H](C[C@@H]([C@@]34[C@@H]2[C@H]([C@@H](C31)[C@@]5([C@@H]6[C@H]4C[C@@]([C@@H]6OC(=O)c7ccccc7)([C@H]([C@@H]5O)OC)O)O)OC)OC)O)COC |
InChi: | InChI=1S/C31H43NO10/c1-32-13-28(14-38-2)17(33)11-18(39-3)30-16-12-29(36)25(42-27(35)15-9-7-6-8-10-15)19(16)31(37,24(34)26(29)41-5)20(23(30)32)21(40-4)22(28)30/h6-10,16-26,33-34,36-37H,11-14H2,1-5H3/t16-,17-,18+,19-,20+,21+,22-,23?,24+,25-,26+,28+,29-,30+,31-/m1/s1 |
InChiKey: | InChIKey=PULWZCUZNRVAHT-IJNXHYLPSA-N |
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