0 B16R1.11435 CC(=O)C(=O)OC1CC(C)CCC1C(C)C Amb22546812 [0,0,0,0,0,0|0,0,2]=2 1 B16R1.11435 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)C(O)O Amb22045237 [0,0,0,0,0,0|1,0,0]=1 2 B16R1.11435 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)[C@@H](C)O Amb2718735 [0,0,0,0,0,0|0,0,0]=0 3 B16R1.11435 CC1CCC(C(C)C)C(OC(=O)C(C)O)C1 Amb1953961 [0,0,0,0,0,0|0,0,0]=0 4 B15R1.3825 C#CC(=O)O[C@@H]1C[C@H](C)CC[C@H]1C(C)C Amb17779643 [1,0,0,0,0,0|0,0,2]=3 5 B15R1.3825 CC1CCC(C(C)C)C(NC(C)CO)C1 Amb9359844 [1,0,0,0,0,0|2,0,1]=4 6 B15R1.3825 CC1CCC(C(C)C)C(OC(=O)CCl)C1 Amb9702660 [1,0,0,0,0,0|1,0,0]=2 7 B15R1.3825 CC1CCC(C(C)C)C(OC(=O)CO)C1 Amb1111301 [1,0,0,0,0,0|0,0,0]=1 8 B15R1.3825 COC(=O)\C=C1\CC(C)CCC1C(C)C Amb26840329 [1,0,0,0,0,0|2,0,1]=4 9 B15R1.8435 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OCC(=O)O Amb34146162 [1,0,0,0,0,0|1,0,2]=4 10 B15R1.8435 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)O Amb3428604 [1,0,0,0,0,0|1,0,2]=4 11 B15R1.8435 CC(C)[C@H]1CC[C@H](C)C[C@@H]1OCC(=O)O Amb3939941 [1,0,0,0,0,0|1,0,2]=4 12 B15R1.8435 CC(O)CNC1CC(C)CCC1C(C)C Amb9246030 [1,0,0,0,0,0|1,0,1]=3 13 B15R1.8435 CC1CCC(C(C)C)C(OCC(=O)O)C1 Amb270382 [1,0,0,0,0,0|1,0,2]=4 14 B15R1.8875 CC(Br)C(=O)NC1CCCCC1C(C)C Amb28189706 [1,0,0,0,0,0|2,0,0]=3 15 B15R1.8875 CC(C)C1CCCCC1NC(=O)C(=O)O Amb27865298 [1,0,0,0,0,0|2,0,1]=4 16 B15R1.8416 CC(C)C(=O)C1CC(=O)CCC1C(C)C Amb32865619 [0,0,0,0,1,0|2,0,1]=4 17 B15R1.8416 CC1CCC(C(C)C)C(C(Br)C(C)C)C1 Amb27765119 [0,0,0,0,1,0|2,0,1]=4 18 B15R1.8416 CC1CCC(C(C)C)C(C(Cl)C(C)C)C1 Amb27592510 [0,0,0,0,1,0|2,0,1]=4 19 B15R1.8416 CC1CN(C(=O)C(C)C)C(C(C)C)CN1 Amb17579465 [0,0,0,0,1,0|3,0,0]=4 20 B14R0.304 CCC(=O)OCCC(C)CCC=C(C)C Amb4016541 [1,0,1,0,0,0|0,0,2]=4 21 B14R1.3135 CCC1CCCCC1\C=C(\C)C(C)O Amb27960105 [2,0,0,0,0,0|2,0,0]=4 22 B14R1.164 C=C(C)C1CCC(C)CC1OC(C)=O Amb6357402 [2,0,0,0,0,0|0,0,2]=4 23 B14R1.164 CC(=O)N[C@@H]1C[C@H](C)CC[C@@H]1C(C)C Amb27859029 [2,0,0,0,0,0|1,0,0]=3 24 B14R1.164 CC(=O)N[C@@H]1C[C@H](C)CC[C@H]1C(C)C Amb28194141 [2,0,0,0,0,0|1,0,0]=3 25 B14R1.164 CC(=O)OC1CC(C)CCC1C(C)C Amb4036823 [2,0,0,0,0,0|0,0,0]=2 26 B14R1.164 CC(=O)O[C@@H]1C[C@@H](C)CC[C@@H]1C(C)C Amb22232055 [2,0,0,0,0,0|0,0,0]=2 27 B14R1.164 CC(=O)O[C@H]1C[C@@H](C)CC[C@@H]1C(C)C Amb6357810 [2,0,0,0,0,0|0,0,0]=2 28 B14R1.164 CC(=O)O[C@H]1C[C@H](C)CC[C@H]1C(C)C Amb22336235 [2,0,0,0,0,0|0,0,0]=2 29 B14R1.164 CC(=O)\C=C1/CC(C)CCC1C(C)C Amb27599676 [2,0,0,0,0,0|1,0,1]=4 30 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CC(=O)O Amb27845505 [2,0,0,0,0,0|1,0,0]=3 31 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)Cl Amb20242385 [2,0,0,0,0,0|1,0,0]=3 32 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(N)=O Amb17844396 [2,0,0,0,0,0|1,0,0]=3 33 B14R1.164 CC(C)[C@@H]1CC[C@H](C)C[C@H]1NC(N)=O Amb27201286 [2,0,0,0,0,0|2,0,0]=4 34 B14R1.164 CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(N)=O Amb27965003 [2,0,0,0,0,0|2,0,0]=4 35 B14R1.164 CC(C)[C@H]1CC[C@H](C)C[C@@H]1OC(=O)Cl Amb8515451 [2,0,0,0,0,0|1,0,0]=3 36 B14R1.164 CC(C)[C@H]1CC[C@H](C)C[C@H]1NC(N)=O Amb27966784 [2,0,0,0,0,0|2,0,0]=4 37 B14R1.164 CC1CCC(C(C)C)C(NC(N)=O)C1 Amb25708464 [2,0,0,0,0,0|2,0,0]=4 38 B14R1.164 CC1CCC(C(C)C)C(OB(O)O)C1 Amb6357472 [2,0,0,0,0,0|1,0,1]=4 39 B14R1.164 CC1CCC(C(C)C)C(OC(=O)Cl)C1 Amb17678766 [2,0,0,0,0,0|1,0,0]=3 40 B14R1.164 CC1CCC(C(C)C)C(OC(N)=O)C1 Amb28245329 [2,0,0,0,0,0|1,0,0]=3 41 B14R1.3302 CC(C)C1CCCCC1NC(=O)CCl Amb27968355 [2,0,0,0,0,0|2,0,0]=4 42 B14R1.3302 CC(C)C1CCCCC1NC(=O)CS Amb27612794 [2,0,0,0,0,0|1,1,0]=4 43 B14R1.3302 CCC(=N)NC1CCCCC1C(C)C Amb27971999 [2,0,0,0,0,0|2,0,0]=4 44 B14R1.3302 CCC(=O)NC1CCCCC1C(C)C Amb27612749 [2,0,0,0,0,0|1,0,0]=3 45 B14R1.3302 CNC(=O)NC1CCCCC1C(C)C Amb27183102 [2,0,0,0,0,0|2,0,0]=4 46 B16R1.1519 CC1CCC(C(C)C)C(OC(=O)CC#N)C1 Amb2386150 [1,1,0,0,0,0|0,0,1]=3 47 B16R1.1519 CCOC(=O)\C=C1\CC(C)CCC1C(C)C Amb33493122 [1,1,0,0,0,0|1,0,1]=4 48 B16R1.1302 CC1CCC(C(C)C)C(OCC(O)CO)C1 Amb24061577 [1,1,0,0,0,0|0,0,1]=3 49 B18R1.17932 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1NC(=O)OC(C)(C)C Amb27672051 [0,1,0,0,0,1|2,0,0]=4 50 B16R2.45634 CC1CCC(C(C)C)C2(CC(=O)CO2)C1 Amb35722263 [1,0,0,1,0,0|1,0,0]=3 51 B16R2.49569 CC(Br)C(=O)NC1CCCCC1C2CC2 Amb35661962 [1,0,0,1,0,0|2,0,0]=4 52 B16R2.49569 CC(Cl)C(=O)NC1CCCCC1C2CC2 Amb35661961 [1,0,0,1,0,0|2,0,0]=4 53 B14R1.707 CC1CCC(C(C)C)C(C(=O)CCl)C1 Amb25865354 [1,0,0,0,1,0|1,0,0]=3 54 B14R1.707 CCC(=O)N1CC(C)NCC1C(C)C Amb17578747 [1,0,0,0,1,0|2,0,0]=4 55 B14R1.707 CCC(Cl)C1CC(C)CCC1C(C)C Amb27162723 [1,0,0,0,1,0|1,0,1]=4 56 B14R1.707 CCC(N)C1CC(C)CCC1C(C)C Amb27459579 [1,0,0,0,1,0|1,0,1]=4 57 B14R1.707 CNC(=O)C1CC(C)CCC1C(C)C Amb27759343 [1,0,0,0,1,0|1,0,0]=3 58 B14R1.707 COC(=O)C1CC(C)CNC1C(C)C Amb28370007 [1,0,0,0,1,0|2,0,0]=4 59 B14R1.707 COC(=O)C1CC(N)CCC1C(C)C Amb32866537 [1,0,0,0,1,0|2,0,0]=4 60 B18R1.10382 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)CCC(=O)O Amb22745847 [0,0,0,0,0,2|1,0,1]=4