0 B5R0.1 CCC=C(C)C Molport-003-938-589 [1,0,0,0,0,0|1,0,1]=3 1 B7R1.4 CC1=CCCC1=O Molport-003-661-909 [0,0,0,1,0,0|1,0,0]=2 2 B7R1.4 CC1CCCC1=O Molport-001-793-641 [0,0,0,1,0,0|1,0,2]=4 3 B7R1.4 CC1CCNC1=O Molport-006-114-492 [0,0,0,1,0,0|1,0,2]=4 4 B7R1.4 CC1CCOC1=O Molport-003-926-035 [0,0,0,1,0,0|0,0,2]=3 5 B7R1.4 CC1NCCC1=O Molport-038-083-438 [0,0,0,1,0,0|2,0,1]=4 6 B7R1.4 CC1OCCC1=O Molport-000-145-970 [0,0,0,1,0,0|2,0,1]=4 7 B7R1.4 C[C@@H]1CCNC1=O Molport-035-682-382 [0,0,0,1,0,0|1,0,2]=4 8 B7R1.4 C[C@@H]1OCCC1=O Molport-019-995-742 [0,0,0,1,0,0|2,0,1]=4 9 B7R1.4 C[C@H]1CCNC1=O Molport-035-682-385 [0,0,0,1,0,0|1,0,2]=4 10 B7R1.4 NC1CCCC1=O Molport-030-004-546 [0,0,0,1,0,0|2,0,1]=4 11 B7R1.4 NC1CCNC1=O Molport-006-013-052 [0,0,0,1,0,0|2,0,1]=4 12 B7R1.4 NC1CCNC1=O Molport-006-703-014 [0,0,0,1,0,0|2,0,1]=4 13 B7R1.4 NC1CCOC1=O Molport-001-768-821 [0,0,0,1,0,0|1,0,1]=3 14 B7R1.4 NC1CCOC1=O Molport-001-787-398 [0,0,0,1,0,0|1,0,1]=3 15 B7R1.4 NC1CCOC1=O Molport-019-989-908 [0,0,0,1,0,0|1,0,1]=3 16 B7R1.4 N[C@@H]1CCNC1=O Molport-004-802-108 [0,0,0,1,0,0|2,0,1]=4 17 B7R1.4 N[C@@H]1CCNC1=O Molport-023-334-029 [0,0,0,1,0,0|2,0,1]=4 18 B7R1.4 N[C@@H]1CCOC1=O Molport-001-793-077 [0,0,0,1,0,0|1,0,1]=3 19 B7R1.4 N[C@@H]1CCOC1=O Molport-003-933-737 [0,0,0,1,0,0|1,0,1]=3 20 B7R1.4 N[C@@H]1CCOC1=O Molport-047-593-259 [0,0,0,1,0,0|1,0,1]=3 21 B7R1.4 N[C@@H]1CCOC1=O Molport-051-697-755 [0,0,0,1,0,0|1,0,1]=3 22 B7R1.4 N[C@H]1CCNC1=O Molport-020-014-697 [0,0,0,1,0,0|2,0,1]=4 23 B7R1.4 N[C@H]1CCNC1=O Molport-027-835-345 [0,0,0,1,0,0|2,0,1]=4 24 B7R1.4 N[C@H]1CCOC1=O Molport-000-882-259 [0,0,0,1,0,0|1,0,1]=3 25 B7R1.4 N[C@H]1CCOC1=O Molport-003-925-555 [0,0,0,1,0,0|1,0,1]=3 26 B7R1.4 O=C1CCOC1=O Molport-051-739-326 [0,0,0,1,0,0|1,0,0]=2 27 B7R1.4 OC1CCCC1=C Molport-046-837-811 [0,0,0,1,0,0|1,0,2]=4 28 B7R1.4 OC1CCCC1=O Molport-022-878-815 [0,0,0,1,0,0|2,0,1]=4 29 B7R1.4 OC1CCNC1=O Molport-006-701-049 [0,0,0,1,0,0|2,0,1]=4 30 B7R1.4 OC1CCOC1=O Molport-001-791-380 [0,0,0,1,0,0|1,0,1]=3 31 B7R1.4 O[C@@H]1CCNC1=O Molport-009-199-892 [0,0,0,1,0,0|2,0,1]=4 32 B7R1.4 O[C@@H]1CCOC1=O Molport-001-794-344 [0,0,0,1,0,0|1,0,1]=3 33 B7R1.4 O[C@H]1CCNC1=O Molport-002-499-339 [0,0,0,1,0,0|2,0,1]=4 34 B7R1.4 O[C@H]1CCOC1=O Molport-001-794-343 [0,0,0,1,0,0|1,0,1]=3 35 B7R1.19 CC(=O)C1(CO1)C Molport-009-013-632 [0,0,0,1,0,0|2,0,1]=4 36 B7R1.22 COC(=O)C1CO1 Molport-009-678-711 [0,0,0,1,0,0|1,0,1]=3 37 B7R1.22 COC(=O)[C@@H]1CO1 Molport-003-933-969 [0,0,0,1,0,0|1,0,1]=3 38 B7R1.22 COC(=O)[C@H]1CO1 Molport-003-933-967 [0,0,0,1,0,0|1,0,1]=3 39 B6R0.4 CC(=CCCN)C Molport-012-948-505 [1,1,0,0,0,0|1,0,1]=4 40 B6R0.4 CC(=CCCO)C Molport-003-929-857 [1,1,0,0,0,0|1,0,1]=4 41 B6R0.4 CCCC=C(C)C Molport-003-910-491 [1,1,0,0,0,0|1,0,1]=4 42 B6R1.2 C=C1CCCC1 Molport-003-928-588 [1,0,0,1,0,0|1,0,1]=4 43 B6R1.2 C=C1CCNC1 Molport-004-969-103 [1,0,0,1,0,0|1,0,1]=4 44 B6R1.11 CC(=C)C1CO1 Molport-028-746-896 [1,0,0,1,0,0|0,0,1]=3 45 B6R1.11 CC(=O)C1CO1 Molport-001-756-793 [1,0,0,1,0,0|1,0,1]=4 46 B6R1.7 CC1(CO1)C=C Molport-001-790-247 [1,0,0,1,0,0|1,0,1]=4 47 B6R1.7 C[C@]1(CO1)C=C Molport-051-570-885 [1,0,0,1,0,0|1,0,1]=4 48 B8R1.1 COC1=CC(=O)CC1 Molport-003-931-699 [0,0,0,1,0,1|2,0,0]=4 49 B8R1.4 CC1CCOC(=O)O1 Molport-046-419-204 [0,0,0,1,0,1|0,0,2]=4 50 B8R1.4 O=C1CCCC(=O)C1 Molport-001-766-691 [0,0,0,1,0,1|2,0,0]=4 51 B8R1.18 CC1CC(=O)NC1=O Molport-009-340-918 [0,0,0,1,0,1|2,0,0]=4 52 B8R1.18 CC1CC(=O)OC1=O Molport-001-792-084 [0,0,0,1,0,1|2,0,0]=4 53 B8R1.18 CC1OC(=C)CC1=O Molport-051-911-897 [0,0,0,1,0,1|2,0,0]=4 54 B8R1.18 CN1CC(=O)CC1=O Molport-022-470-242 [0,0,0,1,0,1|2,0,0]=4 55 B8R1.18 C[C@@H]1CC(=O)NC1=O Molport-051-763-291 [0,0,0,1,0,1|2,0,0]=4 56 B8R1.18 C[C@H]1CC(=O)OC1=O Molport-003-801-082 [0,0,0,1,0,1|2,0,0]=4 57 B8R1.40 COC(=O)CC1CO1 Molport-006-116-275 [0,0,0,1,0,1|1,0,1]=4 58 B8R1.51 CC1(COC(=O)C1)C Molport-028-948-920 [0,0,0,1,0,1|0,0,2]=4 59 B8R1.51 CC1(COC(=O)O1)C Molport-006-116-213 [0,0,0,1,0,1|0,0,2]=4 60 B8R1.19 CC1(CCOC1=O)C Molport-009-198-442 [0,1,0,1,0,0|0,0,2]=4 61 B8R1.19 CC1(CCOC1=O)N Molport-038-949-250 [0,1,0,1,0,0|0,0,2]=4 62 B8R1.11 CCC1CCOC1=O Molport-028-747-647 [0,1,0,1,0,0|0,0,2]=4 63 B8R1.11 CN[C@H]1CCOC1=O Molport-047-770-430 [0,1,0,1,0,0|0,0,2]=4 64 B8R1.11 COC1CCOC1=O Molport-051-487-639 [0,1,0,1,0,0|0,0,2]=4 65 B8R1.11 NCC1CCOC1=O Molport-038-949-533 [0,1,0,1,0,0|0,0,2]=4 66 B8R1.11 O/N=C\1/CCOC1=O Molport-001-790-241 [0,1,0,1,0,0|1,0,0]=3 67 B8R1.11 OCC1=CCCC1=O Molport-019-905-319 [0,1,0,1,0,0|1,0,0]=3 68 B8R1.39 COC(=O)C1(CO1)C Molport-001-780-098 [0,1,0,1,0,0|0,0,2]=4 69 B8R1.50 CC1=C(C(=O)CC1)C Molport-003-931-571 [0,1,0,1,0,0|1,0,0]=3 70 B8R1.50 CC1=C(C(=O)CC1)O Molport-003-987-222 [0,1,0,1,0,0|2,0,0]=4 71 B8R1.50 CC1=C(CCC1=O)O Molport-005-939-471 [0,1,0,1,0,0|1,0,0]=3 72 B8R1.50 CC1C(=O)CCC1=O Molport-001-757-059 [0,1,0,1,0,0|1,0,1]=4 73 B8R1.50 CC1C(=O)COC1=O Molport-003-919-896 [0,1,0,1,0,0|0,0,1]=3 74 B8R1.50 CC1CCC(=O)C1=O Molport-001-766-677 [0,1,0,1,0,0|2,0,0]=4 75 B8R1.50 CC1CCC(=O)C1=O Molport-027-834-657 [0,1,0,1,0,0|2,0,0]=4 76 B8R1.50 CC1COC(=O)C1N Molport-046-831-474 [0,1,0,1,0,0|1,0,1]=4 77 B8R1.50 CC1COC(=O)C1O Molport-047-636-788 [0,1,0,1,0,0|1,0,1]=4 78 B8R1.50 CN1CCC(=C)C1=O Molport-044-560-206 [0,1,0,1,0,0|1,0,0]=3 79 B8R1.50 C[C@H]1CCC(=O)C1=O Molport-051-570-627 [0,1,0,1,0,0|2,0,0]=4 80 B8R1.50 O[C@@H]1COC(=O)[C@@H]1O Molport-003-847-092 [0,1,0,1,0,0|1,0,1]=4 81 B8R1.50 O[C@H]1COC(=O)[C@@H]1O Molport-035-784-237 [0,1,0,1,0,0|1,0,1]=4 82 B8R1.50 O[C@H]1COC(=O)[C@H]1O Molport-047-586-322 [0,1,0,1,0,0|1,0,1]=4