GYPENOSIDE I

pro_cas
85889-20-9
pro_cdbregno
CCD04335710
pro_formula
C45 H76 O18
pro_molWeight
905.077

basic_info

Product_Name: GYPENOSIDE I
CAS: 85889-20-9
EnglishSynonyms: GYPENOSIDE I
pro_mdlNumber: MFCD18643211
pro_acceptors: 18
pro_donors: 12
pro_smile: CC1([C@@H]2CC[C@@H]3[C@@H]([C@]2(CC[C@@H]1O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)C[C@H]([C@H]6[C@]3(CC[C@@H]6[C@](C)(CCC=C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)C)O)C
InChi: InChI=1S/C45H76O18/c1-7-8-13-45(6,63-40-37(57)34(54)31(51)25(18-47)59-40)21-11-14-44(5)20-9-10-27-42(2,3)28(12-15-43(27,4)22(20)16-23(49)29(21)44)61-41-38(35(55)32(52)26(19-48)60-41)62-39-36(56)33(53)30(50)24(17-46)58-39/h7,20-41,46-57H,1,8-19H2,2-6H3/t20-,21+,22+,23-,24-,25-,26-,27+,28+,29+,30-,31-,32+,33+,34+,35+,36-,37-,38-,39+,40+,41+,43-,44+,45+/m1/s1
InChiKey: InChIKey=DIDHBUVQVOGVBA-FZWVADNSSA-N

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