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POLYPHYLLIN A

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Name: POLYPHYLLIN A
CAS: 50773-41-6 ;14144-06-0
Synonyms: POLYPHYLLIN A ; CHONGLOU SAPONIN I ; CHONGLOU SAPONIN POLYPHYLLIN I ; POLYPHYLLIN I
MDL.: MFCD09026938
H bond acceptor: 16
H bond donor: 8
Smile: C[C@@H]1CC[C@@]2([C@H](C3C(O2)CC4[C@@]3(CCC5C4CC=C6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@H]([C@H](CO8)O)O)O)O)O[C@H]9[C@@H]([C@@H]([C@H]([C@@H](O9)C)O)O)O)C)C)C)OC1
InChi: InChI=1S/C44H70O16/c1-19-8-13-44(54-17-19)20(2)30-28(60-44)15-26-24-7-6-22-14-23(9-11-42(22,4)25(24)10-12-43(26,30)5)56-41-38(59-40-35(51)33(49)31(47)21(3)55-40)36(52)37(29(16-45)57-41)58-39-34(50)32(48)27(46)18-53-39/h6,19-21,23-41,45-52H,7-18H2,1-5H3/t19-,20+,21+,23+,24?,25?,26?,27+,28?,29-,30?,31+,32+,33-,34-,35-,36+,37-,38-,39+,40+,41-,42+,43+,44-/m1/s1
InChiKey: InChIKey=HSOMTBUZSIVDQK-SXIAEAMASA-N

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