0 B31R4.3579412452 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CC[C@@H](C4)O)C)C CHEBI:82678 [0,0,0,0,0,0|0,0,2]=2 1 B31R4.3579412452 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CC[C@H](C4)O)C)C CHEBI:82679 [0,0,0,0,0,0|0,0,2]=2 2 B31R4.3579412452 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](CC4=CC(=O)CC[C@]34C)O)C CHEBI:88109 [0,0,0,0,0,0|0,0,4]=4 3 B31R4.3579412452 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CCC(=O)C4)C)O)C CHEBI:88097 [0,0,0,0,0,0|0,0,2]=2 4 B31R4.3579412452 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@@H](C4)O)C)O)C CHEBI:88102 [0,0,0,0,0,0|0,0,0]=0 5 B31R4.3579412452 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:16755 [0,0,0,0,0,0|0,0,0]=0 6 B31R4.3579412452 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CC[C@@H](C4)O)C)O)C CHEBI:43419 [0,0,0,0,0,0|0,0,0]=0 7 B31R4.3579412452 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:9907 [0,0,0,0,0,0|0,0,0]=0 8 B31R4.3579412452 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CC[C@@H](C4)O)C)C CHEBI:78603 [0,0,0,0,0,0|0,0,3]=3 9 B31R4.3579412452 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CC[C@H](C4)O)C)C CHEBI:78605 [0,0,0,0,0,0|0,0,3]=3 10 B31R4.3579412452 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CCC(=O)C4)C)O)C CHEBI:87731 [0,0,0,0,0,0|0,0,3]=3 11 B31R4.3579412452 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@@H](C4)O)C)O)C CHEBI:87730 [0,0,0,0,0,0|0,0,1]=1 12 B31R4.3579412452 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:36234 [0,0,0,0,0,0|0,0,1]=1 13 B31R4.3579412452 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CC[C@@H](C4)O)C)O)C CHEBI:78602 [0,0,0,0,0,0|0,0,1]=1 14 B31R4.3579412452 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:78604 [0,0,0,0,0,0|0,0,1]=1 15 B30R4.540588749 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CCCC4)C)O)C CHEBI:73676 [1,0,0,0,0,0|0,0,0]=1 16 B30R4.2228022101 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CCC(=O)C4)C)C CHEBI:17639 [1,0,0,0,0,0|0,0,2]=3 17 B30R4.2228022101 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@@H](C4)O)C)C CHEBI:81253 [1,0,0,0,0,0|0,0,0]=1 18 B30R4.2228022101 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C CHEBI:16325 [1,0,0,0,0,0|0,0,0]=1 19 B30R4.2228022101 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CCC(=O)C4)C)C CHEBI:11867 [1,0,0,0,0,0|0,0,3]=4 20 B30R4.2228022101 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@@H](C4)O)C)C CHEBI:87728 [1,0,0,0,0,0|0,0,1]=2 21 B30R4.2228022101 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C CHEBI:29744 [1,0,0,0,0,0|0,0,1]=2 22 B32R4.2009115830 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(C(=O)C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:16312 [0,1,0,0,0,0|0,0,1]=2 23 B32R4.2009115830 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:36240 [0,1,0,0,0,0|0,0,0]=1 24 B32R4.2009115830 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:16390 [0,1,0,0,0,0|0,0,2]=3 25 B32R4.2009115830 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CCC(=O)C4)C)O)O)C CHEBI:88108 [0,1,0,0,0,0|0,0,2]=3 26 B32R4.2009115830 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@@H](C4)O)C)O)O)C CHEBI:88105 [0,1,0,0,0,0|0,0,0]=1 27 B32R4.2009115830 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:16359 [0,1,0,0,0,0|0,0,0]=1 28 B32R4.2009115830 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(C(=O)C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:11901 [0,1,0,0,0,0|0,0,2]=3 29 B32R4.2009115830 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:15755 [0,1,0,0,0,0|0,0,1]=2 30 B32R4.2009115830 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:11893 [0,1,0,0,0,0|0,0,3]=4 31 B32R4.2009115830 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CCC(=O)C4)C)O)O)C CHEBI:87736 [0,1,0,0,0,0|0,0,3]=4 32 B32R4.2009115830 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@@H](C4)O)C)O)O)C CHEBI:87735 [0,1,0,0,0,0|0,0,1]=2 33 B32R4.2009115830 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:26711 [0,1,0,0,0,0|0,0,1]=2 34 B32R4.2009115830 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:29747 [0,1,0,0,0,0|0,0,1]=2 35 B32R4.2725916214 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(C([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:134216 [0,1,0,0,0,0|0,0,0]=1 36 B32R4.2725916214 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H]([C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:81244 [0,1,0,0,0,0|0,0,0]=1 37 B32R4.2725916214 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H]([C@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:81243 [0,1,0,0,0,0|0,0,0]=1 38 B32R4.2725916214 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H]([C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:81299 [0,1,0,0,0,0|0,0,0]=1 39 B32R4.2725916214 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H]([C@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:81298 [0,1,0,0,0,0|0,0,0]=1 40 B32R4.2725916214 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H]([C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:133661 [0,1,0,0,0,0|0,0,1]=2 41 B32R4.2725916214 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H]([C@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:134116 [0,1,0,0,0,0|0,0,1]=2 42 B32R4.2725916214 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H]([C@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:134119 [0,1,0,0,0,0|0,0,1]=2 43 B32R4.2795933177 C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:28047 [0,0,0,0,0,1|2,0,1]=4 44 B29R4.6025907869 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CCCC[C@]34C)C CHEBI:49275 [2,0,0,0,0,0|0,0,2]=4 45 B29R4.6025907869 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4[C@@]3(CCCC4)C)C CHEBI:36237 [2,0,0,0,0,0|0,0,0]=2 46 B29R4.6025907869 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCCC4)C)C CHEBI:36239 [2,0,0,0,0,0|0,0,0]=2 47 B29R4.6025907869 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CCCC4)C)C CHEBI:36238 [2,0,0,0,0,0|0,0,0]=2 48 B31R4.2976477974 C[C@H](CCCO)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:50108 [1,1,0,0,0,0|0,0,1]=3 49 B31R4.658664122 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2C=C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:73926 [1,1,0,0,0,0|0,0,2]=4 50 B31R4.658664122 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CCC(=O)C4)C)O)C CHEBI:88104 [1,1,0,0,0,0|0,0,2]=4 51 B31R4.658664122 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@@H](C4)O)C)O)C CHEBI:88098 [1,1,0,0,0,0|0,0,0]=2 52 B31R4.658664122 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:28834 [1,1,0,0,0,0|0,0,0]=2 53 B31R4.658664122 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@@H](C4)O)C)O)C CHEBI:87733 [1,1,0,0,0,0|0,0,1]=3 54 B31R4.658664122 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:23614 [1,1,0,0,0,0|0,0,1]=3 55 B31R4.658664122 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:9177 [1,1,0,0,0,0|0,0,1]=3 56 B31R4.2567562094 CC(CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:363227 [1,1,0,0,0,0|0,0,0]=2 57 B31R4.2567562094 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:52023 [1,1,0,0,0,0|0,0,0]=2 58 B31R4.2567562094 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@H]4[C@@]3(CC[C@@H](C4)O)C)O)C CHEBI:72724 [1,1,0,0,0,0|0,0,0]=2 59 B31R4.2567562094 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:52030 [1,1,0,0,0,0|0,0,0]=2 60 B31R4.2567562094 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:58875 [1,1,0,0,0,0|0,0,1]=3 61 B31R4.2567562094 C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:58876 [1,1,0,0,0,0|0,0,1]=3 62 B33R4.1359992205 C[C@H](CCCC(C)C=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:27428 [0,1,0,0,0,1|1,0,1]=4 63 B33R4.1359992205 C[C@H](CCCC(C)CO)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:28540 [0,1,0,0,0,1|1,0,1]=4 64 B33R4.2741718290 C[C@H](CCCS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:131594 [0,1,0,0,0,1|1,0,0]=3 65 B33R4.2741718290 C[C@H](CCCS(=O)(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:131595 [0,1,0,0,0,1|1,0,1]=4 66 B33R4.2741718290 C[C@H](CCCS(=O)(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CHEBI:90999 [0,1,0,0,0,1|1,0,1]=4 67 B33R4.2673725916 C[C@H](C[C@H](C)C(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CHEBI:488147 [0,2,0,0,0,0|0,0,0]=2 68 B33R4.2986141187 CC[C@@H]1[C@@H]2C[C@@H](CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3[C@@H]1O)CC[C@@H]4[C@H](C)CCC(=O)O)C)C)O CHEBI:43602 [0,2,0,0,0,0|0,0,0]=2