basic_info |
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Product_Name: | 断血流皂苷 A |
CAS: | 142809-89-0 |
中文同义词: | 断血流皂苷 A ; 乙酸,[(3,5-二甲苯甲酰)氨基]羟基- (9CI) |
EnglishSynonyms: | CLINOPODISIDE A |
pro_mdlNumber: | MFCD07781412 |
pro_acceptors: | 19 |
pro_donors: | 13 |
pro_smile: | CC1(CC[C@@]2([C@H](C[C@@]3(C(=C2C1)C=C[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@@]5(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O)C)C)C)O)CO)C |
InChi: | InChI=1S/C48H78O19/c1-43(2)13-14-48(21-52)23(15-43)22-7-8-28-44(3)11-10-30(45(4,20-51)27(44)9-12-46(28,5)47(22,6)16-29(48)53)66-41-38(61)35(58)39(67-42-37(60)34(57)32(55)25(18-50)64-42)26(65-41)19-62-40-36(59)33(56)31(54)24(17-49)63-40/h7-8,24-42,49-61H,9-21H2,1-6H3/t24-,25-,26-,27-,28-,29+,30+,31-,32-,33+,34+,35-,36-,37-,38-,39-,40-,41+,42+,44+,45+,46-,47-,48-/m1/s1 |
InChiKey: | InChIKey=PCWTUTJLXXOQPR-SPBULQMASA-N |
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