1 3OC (1r)-3-oxocyclohexanecarboxylic acid 1.000 2 3HB 3-hydroxybenzoic acid 1.000 3 34D 3,5-dihydroxybenzoate 0.909 4 3HA 3-hydroxyanthranilic acid 0.909 5 4A3 4-amino-3-hydroxybenzoic acid 0.909 6 AW5 3-methyl-5-oxidanyl-benzoic acid 0.909 7 DBH 2,3-dihydroxy-benzoic acid 0.909 8 GTQ 2,5-dihydroxybenzoic acid 0.909 9 HHA (2s,3s)-trans-2,3-dihydro-3-hydroxyanthranilic acid 0.909 10 PF0 3-hydroxy-2-methylbenzoic acid 0.909 11 3HY 3-(hydroxymethyl)phenol 0.900 12 BEZ Benzoic acid 0.900 13 RXK Cyclohexanecarboxylic acid 0.900 14 3DS (4s,5r)-4,5-dihydroxy-3-oxocyclohex-1-ene-1-carboxylic acid 0.833 15 4AA 4-chloro-3-hydroxyanthranilic acid 0.833 16 DHK 3-dehydroshikimate 0.833 17 DHS 3-amino-4,5-dihydroxy-cyclohex-1-enecarboxylate 0.833 18 FA1 2,3 -anhydro-quinic acid 0.833 19 FQZ (1~{R},3~{S},4~{R},5~{R})-3-methyl-4,5-bis(hydroxyl)cyclohexane-1-carboxylic acid 0.833 20 FT5 (3~{R})-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid 0.833 21 GDE 3,4,5-trihydroxybenzoic acid 0.833 22 L6X 4-methoxy-3-oxidanyl-benzoic acid 0.833 23 PVI (4r,5r)-3-amino-4,5-dihydroxy-cyclohexene-1-carboxylic acid 0.833 24 SKM (3r,4s,5r)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid 0.833 25 02K 1-aminocyclohexanecarboxylic acid 0.818 26 174 4-chloro-benzoic acid 0.818 27 1DW 2-bromo-5-hydroxybenzaldehyde 0.818 28 1Y6 4-fluorobenzoic acid 0.818 29 23A 2,3-dihydroxybenzaldehyde 0.818 30 3BZ 3-chlorobenzoate 0.818 31 3SK 2-methylbenzoic acid 0.818 32 3U4 2-fluorobenzoic acid 0.818 33 4MA 4-methylbenzoic acid 0.818 34 53B 6-hydroxypyridine-2-carboxylic acid 0.818 35 53C 1-(3-hydroxyphenyl)ethanone 0.818 36 5HN 5-hydroxypyridine-3-carboxylic acid 0.818 37 6RK 4-azanylcyclohexane-1-carboxylic acid 0.818 38 7LQ (1~{R},2~{R},6~{R})-6-(hydroxymethyl)cyclohex-3-ene-1,2-diol 0.818 39 7WV 2-bromobenzoic acid 0.818 40 8EZ (1~{R},2~{S})-2-methylcyclohexane-1-carboxylic acid 0.818 41 BE2 2-aminobenzoic acid 0.818 42 E6F (1~{S},2~{S})-2-azanylcyclohexane-1-carboxylic acid 0.818 43 GAB 3-aminobenzoic acid 0.818 44 GBC Gabaculine 0.818 45 H6N Protocatechuic aldehyde 0.818 46 JKE 2-sulfanylbenzoic acid 0.818 47 KZ6 4-iodobenzoic acid 0.818 48 MBO Mercuribenzoic acid 0.818 49 MHV 4-oxo-L-pipecolic acid 0.818 50 O78 (3z)-3-iminocyclohex-1-ene-1-carboxylic acid 0.818 51 OVV 3-methylbenzoic acid 0.818 52 PAB 4-aminobenzoic acid 0.818 53 PHB P-hydroxybenzoic acid 0.818 54 QRM 3-aminocyclohexa-1,3-diene-1-carboxylic acid 0.818 55 SAL 2-hydroxybenzoic acid 0.818 56 VDK [(1s,3s)-3-carboxycyclohexyl]azanium 0.818 57 Z82 4-bromobenzoic acid 0.818 58 010 Phenylmethanol 0.800 59 CRS M-cresol 0.800 60 HBX Benzaldehyde 0.800 61 NWO (1s,3s)-3-methylcyclohexan-1-ol 0.800 62 7WR 3-methoxy-4,5-bis(oxidanyl)benzoic acid 0.769 63 8IB 2-hydroxyterephthalic acid 0.769 64 DQA 1,3,4-trihydroxy-5-oxo-cyclohexanecarboxylic acid 0.769 65 FA3 2-anhydro-3-fluoro-quinic acid 0.769 66 FSQ (1~{S},3~{R},4~{S},5~{R})-3-methyl-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid 0.769 67 GJS 4-hydroxybenzene-1,2-dicarboxylic acid 0.769 68 GOG 3-hydroxybenzene-1,2-dicarboxylic acid 0.769 69 H62 (1~{R},2~{R},3~{R},4~{S},6~{S})-6-azanyl-2,3,4-tris(oxidanyl)cyclohexane-1-carboxylic acid 0.769 70 OVU (1~{S},2~{R},4~{R},5~{S},6~{S})-2,4,5-trihydroxy-7-oxabicyclo[4.1.0]heptane-2-carboxylic acid 0.769 71 QIC (1s,3r,4s,5r)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid 0.769 72 WPL (1~{S},3~{S},4~{R},5~{R})-3-methyl-1,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid 0.769 73 069 N,3-dihydroxybenzamide 0.750 74 1CW 3-amino-2-hydroxybenzoic acid 0.750 75 2A9 5-(hydroxymethyl)-2-methoxyphenol 0.750 76 34Z 3,4-dichlorobenzoate 0.750 77 3AZ 3-(aminomethyl)benzoic acid 0.750 78 3F0 2-azanyl-3-fluoranyl-benzoic acid 0.750 79 3HM 5-hydroxy-6-methylpyridine-3-carboxylic acid 0.750 80 3M0 2-azanyl-3-methyl-benzoic acid 0.750 81 4AY 4-(bromomethyl)benzoic acid 0.750 82 4AZ 4-(aminomethyl)benzoic acid 0.750 83 4M0 2-azanyl-4-methyl-benzoic acid 0.750 84 4MI 4-methylsulfanylbenzoic acid 0.750 85 54G 2-hydroxy-5-methylbenzoic acid 0.750 86 5M0 2-azanyl-5-methyl-benzoic acid 0.750 87 5RG 2-amino-5-fluorobenzoic acid 0.750 88 6F0 2-azanyl-6-fluoranyl-benzoic acid 0.750 89 6M1 2-amino-6-methylbenzoic acid 0.750 90 71F 2-methoxybenzoic acid 0.750 91 81P 4-(methylamino)benzoic acid 0.750 92 9TZ 5-fluoranyl-2-methyl-benzoic acid 0.750 93 ADH 1-amino-2,3-dihydroxy-5-hydroxymethyl cyclohex-5-ene 0.750 94 AMH Trans-4-aminomethylcyclohexane-1-carboxylic acid 0.750 95 ANN 4-methoxybenzoic acid 0.750 96 AUU (1s,2s,4r)-2-aminobicyclo[2.2.1]heptane-2-carboxylic acid 0.750 97 BE7 (4-carboxyphenyl)(chloro)mercury 0.750 98 BHA 2-hydroxy-4-aminobenzoic acid 0.750 99 BO0 (1~{S},2~{S},3~{R},4~{R},6~{R})-4-(hydroxymethyl)-7-oxabicyclo[4.1.0]heptane-2,3-diol 0.750 100 CHB 3-chloro-4-hydroxybenzoic acid 0.750 101 D0U 4-azanyl-2-sulfanyl-benzoic acid 0.750 102 D1X 2,6-dioxo-1,2,3,6-tetrahydropyridine-4-carboxylic acid 0.750 103 DB1 2,3-dihydroxybenzamide 0.750 104 DHB 3,4-dihydroxybenzoic acid 0.750 105 DOB 2,4-dihydroxybenzoic acid 0.750 106 E5X 4-(hydroxymethyl)benzoic acid 0.750 107 E9K (1~{R},2~{R},3~{R},4~{R},6~{R})-4-(hydroxymethyl)-7-azabicyclo[4.1.0]heptane-2,3-diol 0.750 108 EGM 4-ethylbenzoic acid 0.750 109 FA0 2-amino-4-fluorobenzoic acid 0.750 110 FHB 3-fluoro-4-hydroxybenzoic acid 0.750 111 G5Y 3-hydroxy-4-oxo-4h-pyran-2-carboxylic acid 0.750 112 GDQ (1~{S},2~{R},3~{R},4~{R},6~{S})-4-(hydroxymethyl)-7-azabicyclo[4.1.0]heptane-2,3-diol 0.750 113 GRE 2,6-dihydroxybenzoic acid 0.750 114 HGB 4-(hydroxymercury)benzoic acid 0.750 115 IHB 3-iodo-4-hydroxybenzoic acid 0.750 116 INO 2-hydroxyisonicotinic acid N-oxide 0.750 117 IT4 4-bromanyl-2-oxidanyl-benzoic acid 0.750 118 L3C 4-(chloromethyl)benzoic acid 0.750 119 MW7 4-ethenylbenzoic acid 0.750 120 OVM 3-methoxybenzoic acid 0.750 121 OVP 3-(methylsulfanyl)benzoic acid 0.750 122 OW4 3-(methylamino)benzoic acid 0.750 123 Q3O 3-hydroxy-4-oxo-1,4-dihydropyridine-2-carboxylic acid 0.750 124 QSB 3 bromo 4 hydroxybenzoic acid 0.750 125 SJ5 (3s,4r,5r)-4,5-dihydroxypiperidine-3-carboxylic acid 0.750 126 SX1 2-amino-5-bromobenzoic acid 0.750 127 2MP 3,4-dimethylphenol 0.727 128 43M 4-chloro-3-methylphenol 0.727 129 4HR (2-bromophenyl)methanol 0.727 130 4JL (4-chlorophenyl)methanol 0.727 131 6PC Pyridine-2-carboxylic acid 0.727 132 7DV 2-methylbenzene-1,4-diol 0.727 133 9W9 3-oxidanylbenzenecarbonitrile 0.727 134 AC0 1-phenylethanone 0.727 135 B74 (3-methylphenyl)methanol 0.727 136 BRB Para-bromobenzyl alcohol 0.727 137 CPI 6-carboxypiperidine 0.727 138 DPL 4-oxoproline 0.727 139 E7I Benzoselenoate 0.727 140 ERH 3,4-dimethylphenol 0.727 141 HB0 Trans-4-(hydroxymethyl)cyclohexanol 0.727 142 HBA P-hydroxybenzaldehyde 0.727 143 HYP 4-hydroxyproline 0.727 144 HZP (4s)-4-hydroxy-L-proline 0.727 145 ID7 (3r)-piperidine-3-carboxylic acid 0.727 146 IOB 3-iodo-benzyl alcohol 0.727 147 MBD 3-methylcatechol 0.727 148 MCT 4-methylcatechol 0.727 149 MN1 4-carboxypiperidine 0.727 150 NIO Nicotinic acid 0.727 151 NK Salicylaldehyde 0.727 152 Q6Z (1r,2r,3s)-3-methylcyclohexane-1,2-diol 0.727 153 S3V Pyridine-4-carboxylic acid 0.727 154 SA9 2-(hydroxymethyl)phenol 0.727 155 SOA Isatoic anhydride 0.727 156 SS1 1-phenylethanol 0.727 157 SS2 (1r)-1-phenylethanol 0.727 158 UNU Benzamide 0.727 159 UY7 (4s)-4-hydroxy-D-proline 0.727 160 UYA (4r)-4-hydroxy-D-proline 0.727 161 VTG (4-methylphenyl)methanol 0.727 162 WM2 Cyclohexanecarboxamide 0.727 163 YCP (2s)-piperidine-2-carboxylic acid 0.727 164 ZK2 (2-methylphenyl)methanol 0.727 165 48P (1r,4r,5r)-1,4,5-trihydroxy-3-hydroxymethylcyclohex-2-ene-1-carboxylic acid 0.714 166 8I4 (2r,3s,5r,6r)-2,3,4,5,6-pentakis(oxidanyl)cyclohexane-1-carboxylic acid 0.714 167 9C4 (2s)-2-hydroxy-3-epiquinic acid 0.714 168 9PY (2r)-2-methyl-3-dehydroquinic acid 0.714 169 FA6 3-hydroxyimino quinic acid 0.714 170 H6B (1~{R},2~{R},3~{R},4~{S},5~{S},6~{R})-7-methyl-3,4,5-tris(oxidanyl)-7-azabicyclo[4.1.0]heptane-2-carboxylic acid 0.714 171 L9D (1s,2r,3s,4s,5s,6r)-2-amino-3,4,5,6-tetrahydroxycyclohexane-1-carboxylic acid 0.714 172 L9Z (1~{S},3~{S},4~{S},5~{R})-3-(aminomethyl)-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid 0.714 173 VAU (1~{R},3~{R},4~{S},5~{R})-3-methyl-1,3,4,5-tetrakis(oxidanyl)cyclohexane-1-carboxylic acid 0.714 174 A2Q Cyclohex-2-en-1-one 0.700 175 CXL Cyclohexanol 0.700 176 CYH Cyclohexanone 0.700 177 IPH Phenol 0.700 178 MBN Toluene 0.700 179 QTE Methylcyclohexane 0.700