0 B29R4.8253908594 CC12C=CC(=O)C=C1CCC3C2C(=O)CC4(C)C3CCC4(O)C(=O)CO Amb4003812 [0,0,0,0,0,0|0,0,2]=2 1 B29R4.8253908594 CC12C=CC(=O)C=C1CCC3C2C(O)CC4(C)C3CCC4(O)C(=O)CO Amb4553083 [0,0,0,0,0,0|0,0,0]=0 2 B29R4.8253908594 CC12CCC(=O)C=C1CCC3C2C(=O)CC4(C)C3CCC4(O)C(=O)CO Amb1783868 [0,0,0,0,0,0|0,0,4]=4 3 B29R4.8253908594 CC12CCC(=O)C=C1CCC3C2C(O)CC4(C)C3CCC4(O)C(=O)CO Amb4157202 [0,0,0,0,0,0|0,0,2]=2 4 B29R4.8253908594 C[C@@]12C=CC(=O)C=C1CC[C@H]3[C@H]2C(=O)C[C@]4(C)[C@@H]3CC[C@@]4(O)C(=O)CO Amb19133689 [0,0,0,0,0,0|0,0,2]=2 5 B29R4.8253908594 C[C@@]12C=CC(=O)C=C1CC[C@H]3[C@H]2[C@H](O)C[C@]4(C)[C@@H]3CC[C@@]4(O)C(=O)CO Amb19297841 [0,0,0,0,0,0|0,0,0]=0 6 B29R4.8253908594 C[C@@]12CCC(=O)C=C1CC[C@H]3[C@H]2[C@H](O)C[C@]4(C)[C@@H]3CC[C@@]4(O)C(=O)CO Amb19132527 [0,0,0,0,0,0|0,0,2]=2 7 B29R4.8253908594 C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CN Amb15690688 [0,0,0,0,0,0|1,0,2]=3 8 B29R4.8253908594 C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO Amb533349 [0,0,0,0,0,0|0,0,2]=2 9 B29R4.8253908594 C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO Amb563329 [0,0,0,0,0,0|0,0,4]=4 10 B29R4.8253908594 C[C@]12CC(=O)[C@H]3[C@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO Amb34915287 [0,0,0,0,0,0|0,0,2]=2 11 B29R4.8253908594 C[C@]12CC(O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO Amb33872457 [0,0,0,0,0,0|0,0,0]=0 12 B29R4.8253908594 C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO Amb533381 [0,0,0,0,0,0|0,0,0]=0 13 B29R4.8253908594 C[C@]12C[C@H](O)[C@H]3[C@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO Amb34915297 [0,0,0,0,0,0|0,0,0]=0 14 B29R4.8253908594 C[C@]12C[C@H](O)[C@H]3[C@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO Amb34915259 [0,0,0,0,0,0|0,0,2]=2 15 B28R4.967132669 C=C(C)[C@@]1(O)CCC2C3CCC4=CC(=O)CCC4(C)C3C(O)CC21C Amb28463916 [1,0,0,0,0,0|1,0,2]=4 16 B28R4.1136611681 C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)CO Amb541035 [1,0,0,0,0,0|0,0,2]=3 17 B28R4.1146461172 CC12CCC(=O)C=C1CCC3C2CCC4(C)C3CCC4(O)C(=O)CO Amb4055839 [1,0,0,0,0,0|0,0,2]=3 18 B28R4.1146461172 CC12CCC(=O)C=C1CCC3C2CCC4(C)C3CC[C@@]4(O)C(=O)CO Amb22757588 [1,0,0,0,0,0|0,0,2]=3 19 B28R4.1146461172 C[C@@]12CCC(=O)C=C1CC[C@H]3[C@H]2CC[C@]4(C)[C@@H]3CC[C@@]4(O)C(=O)CO Amb19131509 [1,0,0,0,0,0|0,0,2]=3 20 B30R4.1310497884 CC1CC2C3CCC4=CC(=O)C=CC4(C)C3C(=O)CC2(C)C1(O)C(=O)CO Amb15690641 [0,1,0,0,0,0|0,0,2]=3 21 B30R4.1310497884 C[C@@H]1C[C@@H]2[C@H]3CCC4=CC(=O)C=C[C@@]4(C)[C@@H]3C(=O)C[C@@]2(C)[C@]1(O)C(=O)CO Amb19132998 [0,1,0,0,0,0|0,0,2]=3 22 B30R4.1310497884 C[C@@]12C=CC(=O)C=C1CC[C@H]3[C@H]2C(O)C[C@]4(C)[C@@H]3C[C@H](O)[C@@]4(O)C(=O)CO Amb22745299 [0,1,0,0,0,0|0,0,0]=1 23 B30R4.1310497884 C[C@]12CC(O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1C[C@@H](O)[C@]2(O)C(=O)CO Amb33872298 [0,1,0,0,0,0|0,0,0]=1 24 B30R4.2468419591 CC1CC2C(C(O)CC3(C)C2CCC3(O)C(=O)CO)C4(C)C=CC(=O)C=C14 Amb9826366 [0,1,0,0,0,0|0,0,0]=1 25 B30R4.2468419591 C[C@@H]1CC2C(C(O)C[C@]3(C)C2CC[C@@]3(O)C(=O)CO)[C@]4(C)C=CC(=O)C=C14 Amb28524821 [0,1,0,0,0,0|0,0,0]=1 26 B30R4.2468419591 C[C@@H]1C[C@H]2[C@@H]([C@H](O)C[C@]3(C)[C@@H]2CC[C@@]3(O)C(=O)CO)[C@]4(C)C=CC(=O)C=C14 Amb19133203 [0,1,0,0,0,0|0,0,0]=1 27 B30R4.2468419591 C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]4(C)C=CC(=O)C=C14 Amb562774 [0,1,0,0,0,0|0,0,0]=1 28 B30R4.2468447894 C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO Amb8396642 [0,1,0,0,0,0|0,0,2]=3 29 B27R4.804624872 CC(=O)[C@@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@@]4(C)[C@@H]3C(O)C[C@@]12C Amb28974301 [2,0,0,0,0,0|0,0,2]=4 30 B27R4.804624872 CC(=O)[C@@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@@]4(C)[C@@H]3[C@@H](O)C[C@@]12C Amb19132702 [2,0,0,0,0,0|0,0,2]=4 31 B27R4.804624872 CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C Amb6600055 [2,0,0,0,0,0|0,0,2]=4 32 B27R4.804627397 CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C Amb533380 [2,0,0,0,0,0|0,0,2]=4 33 B27R4.914463973 CC(CO)C1CCC2C3CCC4=CC(=O)C=CC4(C)C3CCC12C Amb4019753 [2,0,0,0,0,0|1,0,1]=4 34 B27R4.914463973 C[C@@]12CCC(=O)C=C1CC[C@H]3[C@H]2CC[C@@]4(C)[C@H](C(=O)CO)CC[C@H]34 Amb19131507 [2,0,0,0,0,0|0,0,2]=4 35 B29R4.8204278387 C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@@H](O)C[C@]4(CO)[C@@H](C(=O)CO)CC[C@@H]34 Amb22735255 [1,1,0,0,0,0|0,0,2]=4 36 B31R4.3868533394 CC12C=CC(=O)C=C1CCC3C4CC(O)C(O)(C(=O)CO)C4(C)CC(O)C32F Amb2704867 [0,2,0,0,0,0|0,0,0]=2 37 B31R4.3868533394 CC1CC2C3CCC4=CC(=O)C=CC4(C)C3(F)C(O)CC2(C)C1(O)C(=O)CCl Amb534050 [0,2,0,0,0,0|1,0,0]=3 38 B31R4.3868533394 CC1CC2C3CCC4=CC(=O)C=CC4(C)C3(F)C(O)CC2(C)C1(O)C(=O)CO Amb9809252 [0,2,0,0,0,0|0,0,0]=2 39 B31R4.3868533394 C[C@@H]1CC2C3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO Amb4157203 [0,2,0,0,0,0|0,0,0]=2 40 B31R4.3868533394 C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO Amb2719619 [0,2,0,0,0,0|0,0,0]=2 41 B31R4.3868533394 C[C@@H]1C[C@H]2[C@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO Amb34915504 [0,2,0,0,0,0|0,0,0]=2 42 B31R4.3868533394 C[C@@]12C=CC(=O)C=C1CC[C@@H]3C4C[C@H](O)[C@@](O)(C(=O)CO)[C@]4(C)CC(O)[C@]32F Amb28524827 [0,2,0,0,0,0|0,0,0]=2 43 B31R4.3868533394 C[C@@]12C=CC(=O)C=C1CC[C@@H]3[C@H]4C[C@H](O)[C@@](O)(C(=O)CO)[C@]4(C)C[C@@H](O)[C@]32F Amb19134136 [0,2,0,0,0,0|0,0,0]=2 44 B31R4.3868533394 C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO Amb8628204 [0,2,0,0,0,0|0,0,0]=2 45 B31R5.1153117231 CC1CC2C3CCC4=CC(=O)C=CC4(C)C35OC5CC2(C)C1(O)C(=O)CO Amb19854157 [0,1,0,1,0,0|0,0,0]=2 46 B31R5.1153117231 C[C@@H]1C[C@H]2C3CCC4=CC(=O)C=C[C@]4(C)[C@]35O[C@@H]5C[C@]2(C)[C@@]1(O)C(=O)CO Amb533370 [0,1,0,1,0,0|0,0,0]=2 47 B31R5.1153117231 C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]35O[C@H]5C[C@]2(C)[C@@]1(O)C(=O)CO Amb22168427 [0,1,0,1,0,0|0,0,0]=2