INSERT INTO `molecules` (`id`, `name`, `semiSystematicName`, `family`, `subFamily`, `subSubFamily`, `smilesNumeration`, `smiles`, `smilesDisplacement`, `jmeNumeration`, `jme`, `jmeDisplacement`, `molecularFormula`, `molecularWeight`, `solvent`, `reference`, `bibliography`, `publicCom`, `privateCom`, `state`, `authorId`, `created_at`, `updated_at`) VALUES
(15327, '25-O-Methoxyluffariellolide', '', 'Terpenoids', 'Sesterterpenoids', 'Monocarbocyclics', '[CH3:25001]O[CH:25]1O[C:1](=O)[CH:2]=[C:3]1[CH2:4][CH2:5][CH:6]=[C:7]([CH3:24])[CH2:8][CH2:9][CH:10]=[C:11]([CH3:23])[CH2:12][CH2:13][C:14]2=[C:15]([CH3:22])[CH2:16][CH2:17][CH2:18][C:19]2([CH3:20])[CH3:21]', 'COC1OC(=O)C=C1CCC=C(C)CCC=C(C)CCC2=C(C)CCCC2(C)C', '[CH3:57]O[CH:106]1O[C:172](=O)[CH:119]=[C:170]1[CH2:29][CH2:26][CH:124]=[C:138]([CH3:16])[CH2:41][CH2:27][CH:125]=[C:137]([CH3:16])[CH2:42][CH2:29][C:138]2=[C:128]([CH3:29])[CH2:34][CH2:20][CH2:41][C:36]2([CH3:29])[CH3:21]', '29 30 C:25001 22.79 -14.70 C:24 18.49 -12.37 C:23 13.61 -12.37 C:22 11.17 -8.16 C:20 9.61 -11.96 C:21 7.82 -11.96 O 26.95 -11.28 C:10 14.81 -10.28 C:6 19.69 -10.28 C:2 24.63 -10.41 C:9 16.03 -10.99 C:5 20.89 -10.99 C:17 7.50 -8.86 C:8 17.25 -10.28 C:16 8.73 -8.16 C:4 22.10 -10.28 C:12 12.38 -10.28 C:13 11.17 -10.99 C:18 7.50 -10.28 O 22.48 -13.33 O 24.88 -12.66 C:7 18.49 -10.99 C:11 13.61 -10.99 C:1 25.57 -11.44 C:15 9.94 -8.86 C:3 23.35 -10.99 C:14 9.94 -10.28 C:25 23.51 -12.37 C:19 8.73 -10.99 1 20 1 2 22 1 3 23 1 4 25 1 5 29 1 6 29 1 7 24 2 8 11 1 8 23 2 9 12 1 9 22 2 10 24 1 10 26 2 11 14 1 12 16 1 13 15 1 13 19 1 14 22 1 15 25 1 16 26 1 17 18 1 17 23 1 18 27 1 19 29 1 20 28 1 21 24 1 21 28 1 25 27 2 26 28 1 27 29 1', '29 30 C 22.79 -14.70 C 18.49 -12.37 C 13.61 -12.37 C 11.17 -8.16 C 9.61 -11.96 C 7.82 -11.96 O 26.95 -11.28 C 14.81 -10.28 C 19.69 -10.28 C 24.63 -10.41 C 16.03 -10.99 C 20.89 -10.99 C 7.50 -8.86 C 17.25 -10.28 C 8.73 -8.16 C 22.10 -10.28 C 12.38 -10.28 C 11.17 -10.99 C 7.50 -10.28 O 22.48 -13.33 O 24.88 -12.66 C 18.49 -10.99 C 13.61 -10.99 C 25.57 -11.44 C 9.94 -8.86 C 23.35 -10.99 C 9.94 -10.28 C 23.51 -12.37 C 8.73 -10.99 1 20 1 2 22 1 3 23 1 4 25 1 5 29 1 6 29 1 7 24 2 8 11 1 8 23 2 9 12 1 9 22 2 10 24 1 10 26 2 11 14 1 12 16 1 13 15 1 13 19 1 14 22 1 15 25 1 16 26 1 17 18 1 17 23 1 18 27 1 19 29 1 20 28 1 21 24 1 21 28 1 25 27 2 26 28 1 27 29 1', '29 30 C:57 22.79 -14.70 C:16 18.49 -12.37 C:16 13.61 -12.37 C:29 11.17 -8.16 C:29 9.61 -11.96 C:21 7.82 -11.96 O 26.95 -11.28 C:125 14.81 -10.28 C:124 19.69 -10.28 C:119 24.63 -10.41 C:27 16.03 -10.99 C:26 20.89 -10.99 C:20 7.50 -8.86 C:41 17.25 -10.28 C:34 8.73 -8.16 C:29 22.10 -10.28 C:42 12.38 -10.28 C:29 11.17 -10.99 C:41 7.50 -10.28 O 22.48 -13.33 O 24.88 -12.66 C:138 18.49 -10.99 C:137 13.61 -10.99 C:172 25.57 -11.44 C:128 9.94 -8.86 C:170 23.35 -10.99 C:138 9.94 -10.28 C:106 23.51 -12.37 C:36 8.73 -10.99 1 20 1 2 22 1 3 23 1 4 25 1 5 29 1 6 29 1 7 24 2 8 11 1 8 23 2 9 12 1 9 22 2 10 24 1 10 26 2 11 14 1 12 16 1 13 15 1 13 19 1 14 22 1 15 25 1 16 26 1 17 18 1 17 23 1 18 27 1 19 29 1 20 28 1 21 24 1 21 28 1 25 27 2 26 28 1 27 29 1', 'C26H40O3', 400.276, 'M', 'np04_1809_7', 3866, '', '', '1', 47, NULL, NULL),
(15328, '25-O-Ethoxyluffariellolide', '', 'Terpenoids', 'Sesterterpenoids', 'Monocarbocyclics', '[CH3:25002][CH2:25001]O[CH:25]1O[C:1](=O)[CH:2]=[C:3]1[CH2:4][CH2:5][CH:6]=[C:7]([CH3:24])[CH2:8][CH2:9][CH:10]=[C:11]([CH3:23])[CH2:12][CH2:13][C:14]2=[C:15]([CH3:22])[CH2:16][CH2:17][CH2:18][C:19]2([CH3:21])[CH3:20]', 'CCOC1OC(=O)C=C1CCC=C(C)CCC=C(C)CCC2=C(C)CCCC2(C)C', '[CH3:16][CH2:67]O[CH:106]1O[C:173](=O)[CH:119]=[C:170]1[CH2:29][CH2:26][CH:124]=[C:138]([CH3:16])[CH2:41][CH2:27][CH:125]=[C:137]([CH3:16])[CH2:42][CH2:29][C:138]2=[C:128]([CH3:29])[CH2:34][CH2:21][CH2:41][C:36]2([CH3:21])[CH3:29]', '30 31 C:25002 21.80 -15.17 C:24 18.52 -11.88 C:23 13.63 -11.88 C:22 11.19 -7.67 C:21 7.83 -11.47 C:20 9.63 -11.47 O 27.00 -10.79 C:10 14.83 -9.80 C:6 19.72 -9.80 C:2 24.67 -9.93 C:25001 22.83 -14.21 C:9 16.06 -10.50 C:5 20.92 -10.50 C:17 7.51 -8.37 C:8 17.28 -9.80 C:4 22.14 -9.80 C:16 8.74 -7.67 C:12 12.40 -9.80 C:13 11.19 -10.50 C:18 7.51 -9.80 O 22.52 -12.84 O 24.92 -12.17 C:7 18.52 -10.50 C:11 13.63 -10.50 C:1 25.61 -10.95 C:15 9.96 -8.37 C:3 23.39 -10.50 C:14 9.96 -9.80 C:25 23.55 -11.88 C:19 8.74 -10.50 1 11 1 2 23 1 3 24 1 4 26 1 5 30 1 6 30 1 7 25 2 8 12 1 8 24 2 9 13 1 9 23 2 10 25 1 10 27 2 11 21 1 12 15 1 13 16 1 14 17 1 14 20 1 15 23 1 16 27 1 17 26 1 18 19 1 18 24 1 19 28 1 20 30 1 21 29 1 22 25 1 22 29 1 26 28 2 27 29 1 28 30 1', '30 31 C 21.80 -15.17 C 18.52 -11.88 C 13.63 -11.88 C 11.19 -7.67 C 7.83 -11.47 C 9.63 -11.47 O 27.00 -10.79 C 14.83 -9.80 C 19.72 -9.80 C 24.67 -9.93 C 22.83 -14.21 C 16.06 -10.50 C 20.92 -10.50 C 7.51 -8.37 C 17.28 -9.80 C 22.14 -9.80 C 8.74 -7.67 C 12.40 -9.80 C 11.19 -10.50 C 7.51 -9.80 O 22.52 -12.84 O 24.92 -12.17 C 18.52 -10.50 C 13.63 -10.50 C 25.61 -10.95 C 9.96 -8.37 C 23.39 -10.50 C 9.96 -9.80 C 23.55 -11.88 C 8.74 -10.50 1 11 1 2 23 1 3 24 1 4 26 1 5 30 1 6 30 1 7 25 2 8 12 1 8 24 2 9 13 1 9 23 2 10 25 1 10 27 2 11 21 1 12 15 1 13 16 1 14 17 1 14 20 1 15 23 1 16 27 1 17 26 1 18 19 1 18 24 1 19 28 1 20 30 1 21 29 1 22 25 1 22 29 1 26 28 2 27 29 1 28 30 1', '30 31 C:16 21.80 -15.17 C:16 18.52 -11.88 C:16 13.63 -11.88 C:29 11.19 -7.67 C:21 7.83 -11.47 C:29 9.63 -11.47 O 27.00 -10.79 C:125 14.83 -9.80 C:124 19.72 -9.80 C:119 24.67 -9.93 C:67 22.83 -14.21 C:27 16.06 -10.50 C:26 20.92 -10.50 C:21 7.51 -8.37 C:41 17.28 -9.80 C:29 22.14 -9.80 C:34 8.74 -7.67 C:42 12.40 -9.80 C:29 11.19 -10.50 C:41 7.51 -9.80 O 22.52 -12.84 O 24.92 -12.17 C:138 18.52 -10.50 C:137 13.63 -10.50 C:173 25.61 -10.95 C:128 9.96 -8.37 C:170 23.39 -10.50 C:138 9.96 -9.80 C:106 23.55 -11.88 C:36 8.74 -10.50 1 11 1 2 23 1 3 24 1 4 26 1 5 30 1 6 30 1 7 25 2 8 12 1 8 24 2 9 13 1 9 23 2 10 25 1 10 27 2 11 21 1 12 15 1 13 16 1 14 17 1 14 20 1 15 23 1 16 27 1 17 26 1 18 19 1 18 24 1 19 28 1 20 30 1 21 29 1 22 25 1 22 29 1 26 28 2 27 29 1 28 30 1', 'C27H42O3', 414.287, 'M', 'np04_1809_8', 3866, '', '', '1', 47, NULL, NULL),
(15329, '(8Z,13Z,18S,20Z)-22-O-methyl Strobilinin', '', 'Terpenoids', 'Sesterterpenoids', 'Acyclics', '[CH3:22001]O[c:22]1[c:23]([CH3:25])[c:24](=O)o[c:21]1=[CH:20][C@@H:18]([CH3:19])[CH2:17][CH2:16][CH:15]=[C:13]([CH3:14])[CH2:12][CH2:11][CH:10]=[C:8]([CH3:9])[CH2:7][CH2:6][CH2:5][c:3]2[cH:2][cH:1]o[cH:4]2', 'COc1c(C)c(=O)oc1=C[C@@H](C)CCC=C(C)CCC=C(C)CCCc2ccoc2', '[CH3:59]O[c:162]1[c:99]([CH3:9])[c:171](=O)o[c:143]1=[CH:115][C@@H:31]([CH3:21])[CH2:38][CH2:26][CH:125]=[C:135]([CH3:23])[CH2:32][CH2:26][CH:125]=[C:135]([CH3:23])[CH2:31][CH2:28][CH2:25][c:125]2[cH:111][cH:143]o[cH:139]2', '30 31 C:22001 8.26 -15.78 C:14 16.70 -9.41 C:9 20.40 -7.23 C:25 7.07 -13.10 C:19 13.11 -11.55 O 8.26 -10.31 C:10 19.15 -9.32 C:15 15.52 -11.55 C:20 11.92 -13.71 C:1 27.42 -8.39 C:2 26.40 -9.32 C:4 25.48 -7.23 C:11 19.15 -10.71 C:16 15.52 -12.99 C:6 22.78 -8.63 C:12 17.93 -11.44 C:7 21.59 -9.32 C:5 23.99 -9.32 C:17 14.33 -13.71 O 9.48 -15.11 O 26.86 -7.11 O 10.37 -11.62 C:13 16.70 -10.80 C:8 20.40 -8.63 C:3 25.19 -8.63 C:23 8.45 -12.79 C:22 9.48 -13.71 C:24 9.00 -11.50 C:21 10.68 -12.99 C:18 13.11 -12.99 1 20 1 2 23 1 3 24 1 4 26 1 30 5 -1 6 28 2 7 13 1 7 24 2 8 14 1 8 23 2 9 29 2 9 30 1 10 11 2 10 21 1 11 25 1 12 21 1 12 25 2 13 16 1 14 19 1 15 17 1 15 18 1 16 23 1 17 24 1 18 25 1 19 30 1 20 27 1 22 28 1 22 29 1 26 27 2 26 28 1 27 29 1', '30 31 C 8.26 -15.78 C 16.70 -9.41 C 20.40 -7.23 C 7.07 -13.10 C 13.11 -11.55 O 8.26 -10.31 C 19.15 -9.32 C 15.52 -11.55 C 11.92 -13.71 C 27.42 -8.39 C 26.40 -9.32 C 25.48 -7.23 C 19.15 -10.71 C 15.52 -12.99 C 22.78 -8.63 C 17.93 -11.44 C 21.59 -9.32 C 23.99 -9.32 C 14.33 -13.71 O 9.48 -15.11 O 26.86 -7.11 O 10.37 -11.62 C 16.70 -10.80 C 20.40 -8.63 C 25.19 -8.63 C 8.45 -12.79 C 9.48 -13.71 C 9.00 -11.50 C 10.68 -12.99 C 13.11 -12.99 1 20 1 2 23 1 3 24 1 4 26 1 30 5 -1 6 28 2 7 13 1 7 24 2 8 14 1 8 23 2 9 29 2 9 30 1 10 11 2 10 21 1 11 25 1 12 21 1 12 25 2 13 16 1 14 19 1 15 17 1 15 18 1 16 23 1 17 24 1 18 25 1 19 30 1 20 27 1 22 28 1 22 29 1 26 27 2 26 28 1 27 29 1', '30 31 C:59 8.26 -15.78 C:23 16.70 -9.41 C:23 20.40 -7.23 C:9 7.07 -13.10 C:21 13.11 -11.55 O 8.26 -10.31 C:125 19.15 -9.32 C:125 15.52 -11.55 C:115 11.92 -13.71 C:143 27.42 -8.39 C:111 26.40 -9.32 C:139 25.48 -7.23 C:26 19.15 -10.71 C:26 15.52 -12.99 C:28 22.78 -8.63 C:32 17.93 -11.44 C:31 21.59 -9.32 C:25 23.99 -9.32 C:38 14.33 -13.71 O 9.48 -15.11 O 26.86 -7.11 O 10.37 -11.62 C:135 16.70 -10.80 C:135 20.40 -8.63 C:125 25.19 -8.63 C:99 8.45 -12.79 C:162 9.48 -13.71 C:171 9.00 -11.50 C:143 10.68 -12.99 C:31 13.11 -12.99 1 20 1 2 23 1 3 24 1 4 26 1 30 5 -1 6 28 2 7 13 1 7 24 2 8 14 1 8 23 2 9 29 2 9 30 1 10 11 2 10 21 1 11 25 1 12 21 1 12 25 2 13 16 1 14 19 1 15 17 1 15 18 1 16 23 1 17 24 1 18 25 1 19 30 1 20 27 1 22 28 1 22 29 1 26 27 2 26 28 1 27 29 1', 'C26H36O4', 412.276, 'C', 'np97_832_2', 3867, '', '', '1', 47, NULL, NULL),
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(15343, 'Sarcotins I', '', 'Terpenoids', 'Sesterterpenoids', 'Acyclics', '[CH3:9][C:8](=[CH:10][CH:11]=[CH:12][C@@H:13]([CH3:14])[CH2:15][CH2:16][CH:17]=[C:18]([CH3:19])[CH2:20][CH:21](O)[C:22](=O)O)[CH2:7][CH2:6][CH2:5][c:3]1[cH:2][cH:1]o[cH:4]1', 'CC(=CC=C[C@@H](C)CCC=C(C)CC(O)C(=O)O)CCCc1ccoc1', '[CH3:17][C:137](=[CH:126][CH:127]=[CH:139][C@@H:38]([CH3:21])[CH2:39][CH2:27][CH:130]=[C:132]([CH3:25])[CH2:38][CH:71](O)[C:178](=O)O)[CH2:40][CH2:29][CH2:25][c:126]1[cH:112][cH:144]o[cH:140]1', '26 26 C:9 19.70 -11.76 C:19 8.85 -13.86 C:14 14.89 -11.76 O 7.64 -8.95 O 10.06 -8.95 O 7.64 -11.75 C:11 17.30 -13.16 C:10 18.49 -13.86 C:12 16.09 -13.86 C:17 11.27 -13.86 C:1 26.84 -12.92 C:2 25.81 -13.86 C:4 24.89 -11.76 C:16 12.48 -13.16 C:6 22.12 -13.16 C:7 20.91 -13.86 C:5 23.34 -13.86 C:15 13.69 -13.86 C:20 10.06 -11.76 O 26.28 -11.64 C:8 19.70 -13.16 C:18 10.06 -13.16 C:22 8.85 -9.66 C:3 24.60 -13.16 C:13 14.89 -13.16 C:21 8.85 -11.06 1 21 1 2 22 1 25 3 -2 4 23 2 5 23 1 6 26 1 7 8 1 7 9 2 8 21 2 9 25 1 10 14 1 10 22 2 11 12 2 11 20 1 12 24 1 13 20 1 13 24 2 14 18 1 15 16 1 15 17 1 16 21 1 17 24 1 18 25 1 19 22 1 19 26 1 23 26 1', '26 26 C 19.70 -11.76 C 8.85 -13.86 C 14.89 -11.76 O 7.64 -8.95 O 10.06 -8.95 O 7.64 -11.75 C 17.30 -13.16 C 18.49 -13.86 C 16.09 -13.86 C 11.27 -13.86 C 26.84 -12.92 C 25.81 -13.86 C 24.89 -11.76 C 12.48 -13.16 C 22.12 -13.16 C 20.91 -13.86 C 23.34 -13.86 C 13.69 -13.86 C 10.06 -11.76 O 26.28 -11.64 C 19.70 -13.16 C 10.06 -13.16 C 8.85 -9.66 C 24.60 -13.16 C 14.89 -13.16 C 8.85 -11.06 1 21 1 2 22 1 25 3 -2 4 23 2 5 23 1 6 26 1 7 8 1 7 9 2 8 21 2 9 25 1 10 14 1 10 22 2 11 12 2 11 20 1 12 24 1 13 20 1 13 24 2 14 18 1 15 16 1 15 17 1 16 21 1 17 24 1 18 25 1 19 22 1 19 26 1 23 26 1', '26 26 C:17 19.70 -11.76 C:25 8.85 -13.86 C:21 14.89 -11.76 O 7.64 -8.95 O 10.06 -8.95 O 7.64 -11.75 C:127 17.30 -13.16 C:126 18.49 -13.86 C:139 16.09 -13.86 C:130 11.27 -13.86 C:144 26.84 -12.92 C:112 25.81 -13.86 C:140 24.89 -11.76 C:27 12.48 -13.16 C:29 22.12 -13.16 C:40 20.91 -13.86 C:25 23.34 -13.86 C:39 13.69 -13.86 C:38 10.06 -11.76 O 26.28 -11.64 C:137 19.70 -13.16 C:132 10.06 -13.16 C:178 8.85 -9.66 C:126 24.60 -13.16 C:38 14.89 -13.16 C:71 8.85 -11.06 1 21 1 2 22 1 25 3 -2 4 23 2 5 23 1 6 26 1 7 8 1 7 9 2 8 21 2 9 25 1 10 14 1 10 22 2 11 12 2 11 20 1 12 24 1 13 20 1 13 24 2 14 18 1 15 16 1 15 17 1 16 21 1 17 24 1 18 25 1 19 22 1 19 26 1 23 26 1', 'C22H32O4', 360.233, 'M', 'np02_1307_15', 4294, '', '', '1', 47, NULL, NULL);
INSERT INTO `molecules` (`id`, `name`, `semiSystematicName`, `family`, `subFamily`, `subSubFamily`, `smilesNumeration`, `smiles`, `smilesDisplacement`, `jmeNumeration`, `jme`, `jmeDisplacement`, `molecularFormula`, `molecularWeight`, `solvent`, `reference`, `bibliography`, `publicCom`, `privateCom`, `state`, `authorId`, `created_at`, `updated_at`) VALUES
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(15345, '', '', 'Terpenoids', 'Sesterterpenoids', 'Monocarbocyclics', '[CH3:14][C:13](=[CH:12][CH:11]=[CH:10][C@:8]2([CH3:9])[CH2:7][CH2:6][CH2:5][c:3]1[cH:2][cH:1]o[c:4]12)[CH2:15][CH2:16][CH2:17][C@H:18]([CH3:19])[CH:20]=[c:21]3o[c:24](=O)[c:23]([CH3:25])[c:22]3O', 'CC(=CC=C[C@]2(C)CCCc1ccoc12)CCC[C@H](C)C=c3oc(=O)c(C)c3O', '[CH3:17][C:137](=[CH:125][CH:125]=[CH:139][C@:39]2([CH3:26])[CH2:38][CH2:20][CH2:23][c:117]1[cH:110][cH:141]o[c:155]12)[CH2:40][CH2:26][CH2:37][C@H:31]([CH3:21])[CH:116]=[c:143]3o[c:172](=O)[c:100]([CH3:6])[c:162]3O', '29 31 C:14 18.61 -12.33 C:25 7.70 -11.26 C:19 13.74 -12.33 C:9 24.67 -10.24 O 9.23 -13.90 O 9.80 -9.00 C:11 21.01 -10.94 C:12 19.81 -10.24 C:10 22.23 -10.24 C:20 12.53 -10.24 C:1 26.81 -12.33 C:2 26.00 -13.52 C:16 16.16 -10.94 C:6 22.23 -13.05 C:15 17.38 -10.24 C:5 23.45 -13.75 C:17 14.95 -10.24 C:7 22.23 -11.65 O 26.00 -11.26 O 11.17 -12.33 C:13 18.61 -10.94 C:23 9.10 -11.41 C:3 24.67 -13.05 C:22 10.04 -10.37 C:4 24.67 -11.65 C:24 9.80 -12.62 C:21 11.31 -10.94 C:18 13.74 -10.94 C:8 23.45 -10.94 1 21 1 2 22 1 28 3 -2 29 4 -2 5 26 2 6 24 1 7 8 1 7 9 2 8 21 2 29 9 -1 10 27 2 10 28 1 11 12 2 11 19 1 12 23 1 13 15 1 13 17 1 14 16 1 14 18 1 15 21 1 16 23 1 17 28 1 18 29 1 19 25 1 20 26 1 20 27 1 22 24 2 22 26 1 23 25 2 24 27 1 25 29 1', '29 31 C 18.61 -12.33 C 7.70 -11.26 C 13.74 -12.33 C 24.67 -10.24 O 9.23 -13.90 O 9.80 -9.00 C 21.01 -10.94 C 19.81 -10.24 C 22.23 -10.24 C 12.53 -10.24 C 26.81 -12.33 C 26.00 -13.52 C 16.16 -10.94 C 22.23 -13.05 C 17.38 -10.24 C 23.45 -13.75 C 14.95 -10.24 C 22.23 -11.65 O 26.00 -11.26 O 11.17 -12.33 C 18.61 -10.94 C 9.10 -11.41 C 24.67 -13.05 C 10.04 -10.37 C 24.67 -11.65 C 9.80 -12.62 C 11.31 -10.94 C 13.74 -10.94 C 23.45 -10.94 1 21 1 2 22 1 28 3 -2 29 4 -2 5 26 2 6 24 1 7 8 1 7 9 2 8 21 2 29 9 -1 10 27 2 10 28 1 11 12 2 11 19 1 12 23 1 13 15 1 13 17 1 14 16 1 14 18 1 15 21 1 16 23 1 17 28 1 18 29 1 19 25 1 20 26 1 20 27 1 22 24 2 22 26 1 23 25 2 24 27 1 25 29 1', '29 31 C:17 18.61 -12.33 C:6 7.70 -11.26 C:21 13.74 -12.33 C:26 24.67 -10.24 O 9.23 -13.90 O 9.80 -9.00 C:125 21.01 -10.94 C:125 19.81 -10.24 C:139 22.23 -10.24 C:116 12.53 -10.24 C:141 26.81 -12.33 C:110 26.00 -13.52 C:26 16.16 -10.94 C:20 22.23 -13.05 C:40 17.38 -10.24 C:23 23.45 -13.75 C:37 14.95 -10.24 C:38 22.23 -11.65 O 26.00 -11.26 O 11.17 -12.33 C:137 18.61 -10.94 C:100 9.10 -11.41 C:117 24.67 -13.05 C:162 10.04 -10.37 C:155 24.67 -11.65 C:172 9.80 -12.62 C:143 11.31 -10.94 C:31 13.74 -10.94 C:39 23.45 -10.94 1 21 1 2 22 1 28 3 -2 29 4 -2 5 26 2 6 24 1 7 8 1 7 9 2 8 21 2 29 9 -1 10 27 2 10 28 1 11 12 2 11 19 1 12 23 1 13 15 1 13 17 1 14 16 1 14 18 1 15 21 1 16 23 1 17 28 1 18 29 1 19 25 1 20 26 1 20 27 1 22 24 2 22 26 1 23 25 2 24 27 1 25 29 1', 'C25H32O4', 396.265, 'C+C', 'np03_251_3', 3871, '', '', '1', 47, NULL, NULL),
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(15360, 'Dihydronitenin', '', 'Terpenoids', 'Sesterterpenoids', 'Acyclics', '[H][C@@:8]3([CH2:7][CH2:6][CH2:5][c:3]1[cH:2][cH:1]o[cH:4]1)[CH2:10][C@H:11]([CH:12]=[C:13]([CH3:14])[CH2:15][CH2:16][CH2:17][c:18]2[cH:20][cH:21]o[cH:19]2)O[C:9]3=O', '[H][C@@]3(CCCc1ccoc1)C[C@H](C=C(C)CCCc2ccoc2)OC3=O', '[H][C@@:41]3([CH2:30][CH2:28][CH2:25][c:125]1[cH:111][cH:143]o[cH:139]1)[CH2:36][C@H:75]([CH:123]=[C:144]([CH3:17])[CH2:39][CH2:28][CH2:24][c:124]2[cH:111][cH:143]o[cH:139]2)O[C:179]3=O', '26 28 H 20.47 -11.93 C:14 14.77 -10.93 O 19.94 -9.77 C:12 15.97 -13.04 C:21 7.68 -11.85 C:1 26.79 -12.10 C:20 8.62 -12.90 C:2 25.74 -13.04 C:19 9.76 -10.93 C:4 24.82 -10.93 C:16 12.32 -12.34 C:6 22.08 -12.34 C:15 13.54 -13.04 C:17 11.11 -13.04 C:5 23.30 -13.04 C:7 20.87 -13.04 C:10 18.43 -13.04 O 17.69 -10.93 O 8.38 -10.64 O 26.22 -10.81 C:13 14.77 -12.34 C:9 19.15 -10.93 C:18 9.90 -12.34 C:3 24.53 -12.34 C:11 17.20 -12.34 C:8 19.65 -12.34 26 1 -1 2 21 1 3 22 2 4 21 2 4 25 1 5 7 2 5 19 1 6 8 2 6 20 1 7 23 1 8 24 1 9 19 1 9 23 2 10 20 1 10 24 2 11 13 1 11 14 1 12 15 1 12 16 1 13 21 1 14 23 1 15 24 1 16 26 1 17 25 1 17 26 1 18 22 1 25 18 -2 22 26 1', '26 28 H 20.47 -11.93 C 14.77 -10.93 O 19.94 -9.77 C 15.97 -13.04 C 7.68 -11.85 C 26.79 -12.10 C 8.62 -12.90 C 25.74 -13.04 C 9.76 -10.93 C 24.82 -10.93 C 12.32 -12.34 C 22.08 -12.34 C 13.54 -13.04 C 11.11 -13.04 C 23.30 -13.04 C 20.87 -13.04 C 18.43 -13.04 O 17.69 -10.93 O 8.38 -10.64 O 26.22 -10.81 C 14.77 -12.34 C 19.15 -10.93 C 9.90 -12.34 C 24.53 -12.34 C 17.20 -12.34 C 19.65 -12.34 26 1 -1 2 21 1 3 22 2 4 21 2 4 25 1 5 7 2 5 19 1 6 8 2 6 20 1 7 23 1 8 24 1 9 19 1 9 23 2 10 20 1 10 24 2 11 13 1 11 14 1 12 15 1 12 16 1 13 21 1 14 23 1 15 24 1 16 26 1 17 25 1 17 26 1 18 22 1 25 18 -2 22 26 1', '26 28 H 20.47 -11.93 C:17 14.77 -10.93 O 19.94 -9.77 C:123 15.97 -13.04 C:143 7.68 -11.85 C:143 26.79 -12.10 C:111 8.62 -12.90 C:111 25.74 -13.04 C:139 9.76 -10.93 C:139 24.82 -10.93 C:28 12.32 -12.34 C:28 22.08 -12.34 C:39 13.54 -13.04 C:24 11.11 -13.04 C:25 23.30 -13.04 C:30 20.87 -13.04 C:36 18.43 -13.04 O 17.69 -10.93 O 8.38 -10.64 O 26.22 -10.81 C:144 14.77 -12.34 C:179 19.15 -10.93 C:124 9.90 -12.34 C:125 24.53 -12.34 C:75 17.20 -12.34 C:41 19.65 -12.34 26 1 -1 2 21 1 3 22 2 4 21 2 4 25 1 5 7 2 5 19 1 6 8 2 6 20 1 7 23 1 8 24 1 9 19 1 9 23 2 10 20 1 10 24 2 11 13 1 11 14 1 12 15 1 12 16 1 13 21 1 14 23 1 15 24 1 16 26 1 17 25 1 17 26 1 18 22 1 25 18 -2 22 26 1', 'C21H26O4', 342.23, 'C', 'np96_869_2', 3873, '', '', '1', 47, NULL, NULL);
INSERT INTO `molecules` (`id`, `name`, `semiSystematicName`, `family`, `subFamily`, `subSubFamily`, `smilesNumeration`, `smiles`, `smilesDisplacement`, `jmeNumeration`, `jme`, `jmeDisplacement`, `molecularFormula`, `molecularWeight`, `solvent`, `reference`, `bibliography`, `publicCom`, `privateCom`, `state`, `authorId`, `created_at`, `updated_at`) VALUES
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INSERT INTO `molecules` (`id`, `name`, `semiSystematicName`, `family`, `subFamily`, `subSubFamily`, `smilesNumeration`, `smiles`, `smilesDisplacement`, `jmeNumeration`, `jme`, `jmeDisplacement`, `molecularFormula`, `molecularWeight`, `solvent`, `reference`, `bibliography`, `publicCom`, `privateCom`, `state`, `authorId`, `created_at`, `updated_at`) VALUES
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INSERT INTO `molecules` (`id`, `name`, `semiSystematicName`, `family`, `subFamily`, `subSubFamily`, `smilesNumeration`, `smiles`, `smilesDisplacement`, `jmeNumeration`, `jme`, `jmeDisplacement`, `molecularFormula`, `molecularWeight`, `solvent`, `reference`, `bibliography`, `publicCom`, `privateCom`, `state`, `authorId`, `created_at`, `updated_at`) VALUES
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(15403, 'Propindilactone A', '', 'Terpenoids', 'Triterpenoids', 'Schiartanes', '[H][C@@:1]16[CH2:2][C:3](=O)O[C@@:10]15[CH2:19][C@:9]34[CH2:11][C:12](=O)[C@:13]7([CH3:18])[C:17](=O)[C@:20]([CH3:21])(O)[C@:22]8(O)[C@H:23]2O[C:26](=O)[C@@H:25]([CH3:27])[C@@:24]2([H])O[C@@:15](O3)([C@H:14](O)[C@:8]4([H])[CH2:7][CH2:6][C@@:5]5([H])[C@:4]([CH3:28])([CH2:29]O)O6)[C@:16]78[H]', '[H][C@@]16CC(=O)O[C@@]15C[C@]34CC(=O)[C@]7(C)C(=O)[C@](C)(O)[C@]8(O)[C@H]2OC(=O)[C@@H](C)[C@@]2([H])O[C@@](O3)([C@H](O)[C@]4([H])CC[C@@]5([H])[C@](C)(CO)O6)[C@]78[H]', '[H][C@@:82]16[CH2:35][C:175](=O)O[C@@:97]15[CH2:43][C@:83]34[CH2:58][C:206](=O)[C@:65]7([CH3:24])[C:220](=O)[C@:81]([CH3:20])(O)[C@:77]8(O)[C@H:77]2O[C:178](=O)[C@@H:43]([CH3:9])[C@@:74]2([H])O[C@@:103](O3)([C@H:77](O)[C@:51]4([H])[CH2:23][CH2:24][C@@:56]5([H])[C@:87]([CH3:17])([CH2:68]O)O6)[C@:56]78[H]', '47 54 H 11.13 -9.24 H 20.36 -14.35 H 16.30 -12.91 H 12.68 -12.74 H 19.81 -11.92 C:27 21.38 -16.03 C:21 22.73 -10.38 C:28 11.54 -13.35 C:18 19.20 -8.23 O 13.99 -6.78 O 24.25 -14.87 O 18.20 -7.50 O 20.58 -7.50 O 10.22 -14.00 O 17.06 -14.00 O 22.52 -8.94 O 22.33 -11.03 C:29 10.22 -12.60 C:7 15.20 -12.91 C:6 13.78 -12.91 C:2 12.16 -8.29 C:11 16.55 -9.14 C:19 14.48 -9.76 O 23.06 -12.74 O 14.19 -9.14 O 10.88 -10.57 O 19.42 -13.53 O 17.76 -10.83 C:3 13.42 -8.07 C:26 23.06 -14.12 C:12 17.97 -8.87 C:17 20.36 -8.87 C:25 21.72 -14.64 C:14 17.35 -12.60 C:23 21.59 -12.32 C:1 11.95 -9.65 C:20 21.38 -9.76 C:24 20.83 -13.53 C:8 16.10 -11.79 C:4 11.46 -11.92 C:5 12.89 -11.79 C:13 19.20 -9.65 C:16 19.51 -11.03 C:9 15.80 -10.38 C:22 20.92 -11.03 C:15 18.77 -12.23 C:10 13.22 -10.38 36 1 -1 38 2 -2 39 3 -1 41 4 -2 43 5 -1 33 6 -1 37 7 -1 40 8 -1 42 9 -1 10 29 2 11 30 2 12 31 2 13 32 2 14 18 1 34 15 -2 37 16 -2 45 17 -1 40 18 -2 19 20 1 19 39 1 20 41 1 21 29 1 21 36 1 22 31 1 22 44 1 23 44 1 23 47 1 24 30 1 35 24 -1 25 29 1 47 25 -2 26 36 1 26 40 1 27 38 1 27 46 1 44 28 -2 46 28 -2 30 33 1 31 42 1 32 37 1 32 42 1 33 38 1 34 39 1 34 46 1 35 38 1 35 45 1 36 47 1 37 45 1 39 44 1 40 41 1 41 47 1 42 43 1 43 45 1 43 46 1', '47 54 H 11.13 -9.24 H 20.36 -14.35 H 16.30 -12.91 H 12.68 -12.74 H 19.81 -11.92 C 21.38 -16.03 C 22.73 -10.38 C 11.54 -13.35 C 19.20 -8.23 O 13.99 -6.78 O 24.25 -14.87 O 18.20 -7.50 O 20.58 -7.50 O 10.22 -14.00 O 17.06 -14.00 O 22.52 -8.94 O 22.33 -11.03 C 10.22 -12.60 C 15.20 -12.91 C 13.78 -12.91 C 12.16 -8.29 C 16.55 -9.14 C 14.48 -9.76 O 23.06 -12.74 O 14.19 -9.14 O 10.88 -10.57 O 19.42 -13.53 O 17.76 -10.83 C 13.42 -8.07 C 23.06 -14.12 C 17.97 -8.87 C 20.36 -8.87 C 21.72 -14.64 C 17.35 -12.60 C 21.59 -12.32 C 11.95 -9.65 C 21.38 -9.76 C 20.83 -13.53 C 16.10 -11.79 C 11.46 -11.92 C 12.89 -11.79 C 19.20 -9.65 C 19.51 -11.03 C 15.80 -10.38 C 20.92 -11.03 C 18.77 -12.23 C 13.22 -10.38 36 1 -1 38 2 -2 39 3 -1 41 4 -2 43 5 -1 33 6 -1 37 7 -1 40 8 -1 42 9 -1 10 29 2 11 30 2 12 31 2 13 32 2 14 18 1 34 15 -2 37 16 -2 45 17 -1 40 18 -2 19 20 1 19 39 1 20 41 1 21 29 1 21 36 1 22 31 1 22 44 1 23 44 1 23 47 1 24 30 1 35 24 -1 25 29 1 47 25 -2 26 36 1 26 40 1 27 38 1 27 46 1 44 28 -2 46 28 -2 30 33 1 31 42 1 32 37 1 32 42 1 33 38 1 34 39 1 34 46 1 35 38 1 35 45 1 36 47 1 37 45 1 39 44 1 40 41 1 41 47 1 42 43 1 43 45 1 43 46 1', '47 54 H 11.13 -9.24 H 20.36 -14.35 H 16.30 -12.91 H 12.68 -12.74 H 19.81 -11.92 C:9 21.38 -16.03 C:20 22.73 -10.38 C:17 11.54 -13.35 C:24 19.20 -8.23 O 13.99 -6.78 O 24.25 -14.87 O 18.20 -7.50 O 20.58 -7.50 O 10.22 -14.00 O 17.06 -14.00 O 22.52 -8.94 O 22.33 -11.03 C:68 10.22 -12.60 C:23 15.20 -12.91 C:24 13.78 -12.91 C:35 12.16 -8.29 C:58 16.55 -9.14 C:43 14.48 -9.76 O 23.06 -12.74 O 14.19 -9.14 O 10.88 -10.57 O 19.42 -13.53 O 17.76 -10.83 C:175 13.42 -8.07 C:178 23.06 -14.12 C:206 17.97 -8.87 C:220 20.36 -8.87 C:43 21.72 -14.64 C:77 17.35 -12.60 C:77 21.59 -12.32 C:82 11.95 -9.65 C:81 21.38 -9.76 C:74 20.83 -13.53 C:51 16.10 -11.79 C:87 11.46 -11.92 C:56 12.89 -11.79 C:65 19.20 -9.65 C:56 19.51 -11.03 C:83 15.80 -10.38 C:77 20.92 -11.03 C:103 18.77 -12.23 C:97 13.22 -10.38 36 1 -1 38 2 -2 39 3 -1 41 4 -2 43 5 -1 33 6 -1 37 7 -1 40 8 -1 42 9 -1 10 29 2 11 30 2 12 31 2 13 32 2 14 18 1 34 15 -2 37 16 -2 45 17 -1 40 18 -2 19 20 1 19 39 1 20 41 1 21 29 1 21 36 1 22 31 1 22 44 1 23 44 1 23 47 1 24 30 1 35 24 -1 25 29 1 47 25 -2 26 36 1 26 40 1 27 38 1 27 46 1 44 28 -2 46 28 -2 30 33 1 31 42 1 32 37 1 32 42 1 33 38 1 34 39 1 34 46 1 35 38 1 35 45 1 36 47 1 37 45 1 39 44 1 40 41 1 41 47 1 42 43 1 43 45 1 43 46 1', 'C29H36O13', 592.342, 'P', 'hca07_1399_1', 3883, '', '', '1', 47, NULL, NULL);
INSERT INTO `molecules` (`id`, `name`, `semiSystematicName`, `family`, `subFamily`, `subSubFamily`, `smilesNumeration`, `smiles`, `smilesDisplacement`, `jmeNumeration`, `jme`, `jmeDisplacement`, `molecularFormula`, `molecularWeight`, `solvent`, `reference`, `bibliography`, `publicCom`, `privateCom`, `state`, `authorId`, `created_at`, `updated_at`) VALUES
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INSERT INTO `molecules` (`id`, `name`, `semiSystematicName`, `family`, `subFamily`, `subSubFamily`, `smilesNumeration`, `smiles`, `smilesDisplacement`, `jmeNumeration`, `jme`, `jmeDisplacement`, `molecularFormula`, `molecularWeight`, `solvent`, `reference`, `bibliography`, `publicCom`, `privateCom`, `state`, `authorId`, `created_at`, `updated_at`) VALUES
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INSERT INTO `molecules` (`id`, `name`, `semiSystematicName`, `family`, `subFamily`, `subSubFamily`, `smilesNumeration`, `smiles`, `smilesDisplacement`, `jmeNumeration`, `jme`, `jmeDisplacement`, `molecularFormula`, `molecularWeight`, `solvent`, `reference`, `bibliography`, `publicCom`, `privateCom`, `state`, `authorId`, `created_at`, `updated_at`) VALUES
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(15436, 'Acutissimatriterpene D', '', 'Terpenoids', 'Triterpenoids', 'Cycloapotirucallanes', '[H][C@@:17]3([C:20]2=[CH:22][C@:23]1([CH2:24][C@:25]([CH3:27])(O[CH3:25001])[CH2:26]O1)O[C:21]2=O)[CH2:16][CH2:15][C@:14]49[CH2:18][C@:13]34[CH2:12][CH2:11][C@:9]8([H])[C@@:10]7([CH3:19])[CH2:1][CH:2]=[C:3]6[CH2:108][C@@H:107]([c:101]5[cH:106][cH:105][cH:104][cH:103][cH:102]5)O[CH2:29][C@:4]6([CH3:28])[C@:5]7([H])[CH2:6][C@@H:7](O)[C@:8]89[CH3:30]', '[H][C@@]3(C2=C[C@]1(C[C@](C)(OC)CO1)OC2=O)CC[C@]49C[C@]34CC[C@]8([H])[C@@]7(C)CC=C6C[C@@H](c5ccccc5)OC[C@]6(C)[C@]7([H])C[C@@H](O)[C@]89C', '[H][C@@:43]3([C:139]2=[CH:143][C@:113]1([CH2:45][C@:82]([CH3:22])(O[CH3:51])[CH2:79]O1)O[C:171]2=O)[CH2:28][CH2:27][C@:36]49[CH2:14][C@:28]34[CH2:26][CH2:16][C@:43]8([H])[C@@:37]7([CH3:17])[CH2:40][CH:118]=[C:140]6[CH2:41][C@@H:82]([c:143]5[cH:126][cH:128][cH:128][cH:128][cH:126]5)O[CH2:73][C@:38]6([CH3:24])[C@:44]7([H])[CH2:24][C@@H:74](O)[C@:39]89[CH3:20]', '48 56 H 20.26 -8.73 H 17.00 -12.36 H 15.68 -14.68 C:25001 26.17 -7.59 C:27 26.07 -4.77 C:28 14.40 -12.89 C:19 15.68 -10.60 C:30 18.29 -10.60 O 19.19 -6.86 O 19.48 -14.29 C:2 13.19 -12.07 C:22 22.76 -7.59 C:104 8.34 -17.78 C:105 9.54 -18.49 C:103 8.34 -16.38 C:106 10.75 -17.78 C:102 9.54 -15.69 C:1 14.40 -11.31 C:16 21.79 -10.60 C:11 17.00 -9.85 C:15 20.96 -11.74 C:12 18.29 -9.13 C:26 24.07 -4.34 C:29 14.40 -15.69 C:108 11.98 -14.29 C:6 17.00 -14.29 C:24 24.07 -6.60 C:18 20.41 -10.60 O 26.17 -6.16 O 13.19 -16.38 O 22.76 -4.77 O 21.42 -5.72 C:21 20.58 -6.86 C:3 13.19 -13.58 C:20 21.42 -8.02 C:101 10.75 -16.38 C:7 18.29 -13.58 C:107 11.98 -15.69 C:25 24.92 -5.48 C:17 20.96 -9.42 C:4 14.40 -14.29 C:9 17.00 -11.31 C:5 15.68 -13.58 C:23 22.76 -6.16 C:10 15.68 -12.07 C:8 18.29 -12.07 C:13 19.59 -9.85 C:14 19.59 -11.31 40 1 -1 42 2 -2 43 3 -2 4 29 1 39 5 -2 41 6 -2 45 7 -1 46 8 -1 9 33 2 37 10 -2 11 18 1 11 34 2 12 35 2 12 44 1 13 14 2 13 15 1 14 16 1 15 17 2 16 36 2 17 36 1 18 45 1 19 21 1 19 40 1 20 22 1 20 42 1 21 48 1 22 47 1 23 31 1 23 39 1 24 30 1 24 41 1 25 34 1 25 38 1 26 37 1 26 43 1 27 39 1 44 27 -1 47 28 -2 48 28 -2 39 29 -1 30 38 1 44 31 -2 32 33 1 32 44 1 33 35 1 34 41 1 35 40 1 38 36 -2 37 46 1 40 47 1 41 43 1 42 45 1 42 46 1 43 45 1 46 48 1 47 48 1', '48 56 H 20.26 -8.73 H 17.00 -12.36 H 15.68 -14.68 C 26.17 -7.59 C 26.07 -4.77 C 14.40 -12.89 C 15.68 -10.60 C 18.29 -10.60 O 19.19 -6.86 O 19.48 -14.29 C 13.19 -12.07 C 22.76 -7.59 C 8.34 -17.78 C 9.54 -18.49 C 8.34 -16.38 C 10.75 -17.78 C 9.54 -15.69 C 14.40 -11.31 C 21.79 -10.60 C 17.00 -9.85 C 20.96 -11.74 C 18.29 -9.13 C 24.07 -4.34 C 14.40 -15.69 C 11.98 -14.29 C 17.00 -14.29 C 24.07 -6.60 C 20.41 -10.60 O 26.17 -6.16 O 13.19 -16.38 O 22.76 -4.77 O 21.42 -5.72 C 20.58 -6.86 C 13.19 -13.58 C 21.42 -8.02 C 10.75 -16.38 C 18.29 -13.58 C 11.98 -15.69 C 24.92 -5.48 C 20.96 -9.42 C 14.40 -14.29 C 17.00 -11.31 C 15.68 -13.58 C 22.76 -6.16 C 15.68 -12.07 C 18.29 -12.07 C 19.59 -9.85 C 19.59 -11.31 40 1 -1 42 2 -2 43 3 -2 4 29 1 39 5 -2 41 6 -2 45 7 -1 46 8 -1 9 33 2 37 10 -2 11 18 1 11 34 2 12 35 2 12 44 1 13 14 2 13 15 1 14 16 1 15 17 2 16 36 2 17 36 1 18 45 1 19 21 1 19 40 1 20 22 1 20 42 1 21 48 1 22 47 1 23 31 1 23 39 1 24 30 1 24 41 1 25 34 1 25 38 1 26 37 1 26 43 1 27 39 1 44 27 -1 47 28 -2 48 28 -2 39 29 -1 30 38 1 44 31 -2 32 33 1 32 44 1 33 35 1 34 41 1 35 40 1 38 36 -2 37 46 1 40 47 1 41 43 1 42 45 1 42 46 1 43 45 1 46 48 1 47 48 1', '48 56 H 20.26 -8.73 H 17.00 -12.36 H 15.68 -14.68 C:51 26.17 -7.59 C:22 26.07 -4.77 C:24 14.40 -12.89 C:17 15.68 -10.60 C:20 18.29 -10.60 O 19.19 -6.86 O 19.48 -14.29 C:118 13.19 -12.07 C:143 22.76 -7.59 C:128 8.34 -17.78 C:128 9.54 -18.49 C:128 8.34 -16.38 C:126 10.75 -17.78 C:126 9.54 -15.69 C:40 14.40 -11.31 C:28 21.79 -10.60 C:16 17.00 -9.85 C:27 20.96 -11.74 C:26 18.29 -9.13 C:79 24.07 -4.34 C:73 14.40 -15.69 C:41 11.98 -14.29 C:24 17.00 -14.29 C:45 24.07 -6.60 C:14 20.41 -10.60 O 26.17 -6.16 O 13.19 -16.38 O 22.76 -4.77 O 21.42 -5.72 C:171 20.58 -6.86 C:140 13.19 -13.58 C:139 21.42 -8.02 C:143 10.75 -16.38 C:74 18.29 -13.58 C:82 11.98 -15.69 C:82 24.92 -5.48 C:43 20.96 -9.42 C:38 14.40 -14.29 C:43 17.00 -11.31 C:44 15.68 -13.58 C:113 22.76 -6.16 C:37 15.68 -12.07 C:39 18.29 -12.07 C:28 19.59 -9.85 C:36 19.59 -11.31 40 1 -1 42 2 -2 43 3 -2 4 29 1 39 5 -2 41 6 -2 45 7 -1 46 8 -1 9 33 2 37 10 -2 11 18 1 11 34 2 12 35 2 12 44 1 13 14 2 13 15 1 14 16 1 15 17 2 16 36 2 17 36 1 18 45 1 19 21 1 19 40 1 20 22 1 20 42 1 21 48 1 22 47 1 23 31 1 23 39 1 24 30 1 24 41 1 25 34 1 25 38 1 26 37 1 26 43 1 27 39 1 44 27 -1 47 28 -2 48 28 -2 39 29 -1 30 38 1 44 31 -2 32 33 1 32 44 1 33 35 1 34 41 1 35 40 1 38 36 -2 37 46 1 40 47 1 41 43 1 42 45 1 42 46 1 43 45 1 46 48 1 47 48 1', 'C39H50O6', 614.438, 'C', 'np08_655_4', 3889, '', '', '1', 47, NULL, NULL);
INSERT INTO `molecules` (`id`, `name`, `semiSystematicName`, `family`, `subFamily`, `subSubFamily`, `smilesNumeration`, `smiles`, `smilesDisplacement`, `jmeNumeration`, `jme`, `jmeDisplacement`, `molecularFormula`, `molecularWeight`, `solvent`, `reference`, `bibliography`, `publicCom`, `privateCom`, `state`, `authorId`, `created_at`, `updated_at`) VALUES
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'[H][C@@:47]3([CH:42]2[C:175](=O)O[C@@:112]1([CH2:45][C@@:83]([CH3:19])(O[CH3:51])[CH2:77]O1)[C@@H:72]2O)[CH2:22][CH2:26][C@:34]4%10[CH2:14][C@:26]34[CH2:25][CH2:16][C@:44]9([H])[C@@:37]8([CH3:17])[CH2:40][CH:118]=[C:140]7[CH2:41][C@@H:82]([c:137]6[cH:119][cH:108][c:147]5O[CH2:101]O[c:148]5[cH:107]6)O[CH2:73][C@:38]7([CH3:24])[C@:44]8([H])[CH2:24][C@@H:74](O)[C@:38]9%10[CH3:20]', '52 61 H 21.33 -8.73 H 18.07 -12.36 H 16.75 -14.68 C:25001 27.24 -7.59 C:27 27.14 -4.77 C:28 15.47 -12.89 C:19 16.75 -10.60 C:30 19.36 -10.60 O 20.26 -6.86 O 20.55 -14.29 O 24.95 -8.43 C:2 14.26 -12.07 C:106 11.82 -17.78 C:105 10.61 -18.49 C:102 10.61 -15.69 C:103001 7.25 -17.08 C:1 15.47 -11.31 C:16 22.86 -10.60 C:11 18.07 -9.85 C:15 22.03 -11.74 C:12 19.36 -9.13 C:26 25.14 -4.34 C:29 15.47 -15.69 C:108 13.05 -14.29 C:6 18.07 -14.29 C:24 25.14 -6.60 C:18 21.48 -10.60 O 27.24 -6.16 O 8.07 -18.21 O 8.07 -15.95 O 14.26 -16.38 O 23.83 -4.77 O 22.49 -5.72 C:21 21.65 -6.86 C:3 14.26 -13.58 C:101 11.82 -16.38 C:104 9.40 -17.78 C:103 9.40 -16.38 C:7 19.36 -13.58 C:22 23.83 -7.59 C:107 13.05 -15.69 C:20 22.49 -8.02 C:25 25.99 -5.48 C:17 22.03 -9.42 C:4 15.47 -14.29 C:9 18.07 -11.31 C:5 16.75 -13.58 C:10 16.75 -12.07 C:8 19.36 -12.07 C:23 23.83 -6.16 C:13 20.66 -9.85 C:14 20.66 -11.31 44 1 -1 46 2 -2 47 3 -2 4 28 1 43 5 -1 45 6 -2 48 7 -1 49 8 -1 9 34 2 39 10 -2 40 11 -2 12 17 1 12 35 2 13 14 1 13 36 2 14 37 2 15 36 1 15 38 2 16 29 1 16 30 1 17 48 1 18 20 1 18 44 1 19 21 1 19 46 1 20 52 1 21 51 1 22 32 1 22 43 1 23 31 1 23 45 1 24 35 1 24 41 1 25 39 1 25 47 1 26 43 1 50 26 -1 51 27 -2 52 27 -2 43 28 -2 29 37 1 30 38 1 31 41 1 50 32 -2 33 34 1 33 50 1 34 42 1 35 45 1 41 36 -2 37 38 1 39 49 1 40 42 1 40 50 1 42 44 1 44 51 1 45 47 1 46 48 1 46 49 1 47 48 1 49 52 1 51 52 1', '52 61 H 21.33 -8.73 H 18.07 -12.36 H 16.75 -14.68 C 27.24 -7.59 C 27.14 -4.77 C 15.47 -12.89 C 16.75 -10.60 C 19.36 -10.60 O 20.26 -6.86 O 20.55 -14.29 O 24.95 -8.43 C 14.26 -12.07 C 11.82 -17.78 C 10.61 -18.49 C 10.61 -15.69 C 7.25 -17.08 C 15.47 -11.31 C 22.86 -10.60 C 18.07 -9.85 C 22.03 -11.74 C 19.36 -9.13 C 25.14 -4.34 C 15.47 -15.69 C 13.05 -14.29 C 18.07 -14.29 C 25.14 -6.60 C 21.48 -10.60 O 27.24 -6.16 O 8.07 -18.21 O 8.07 -15.95 O 14.26 -16.38 O 23.83 -4.77 O 22.49 -5.72 C 21.65 -6.86 C 14.26 -13.58 C 11.82 -16.38 C 9.40 -17.78 C 9.40 -16.38 C 19.36 -13.58 C 23.83 -7.59 C 13.05 -15.69 C 22.49 -8.02 C 25.99 -5.48 C 22.03 -9.42 C 15.47 -14.29 C 18.07 -11.31 C 16.75 -13.58 C 16.75 -12.07 C 19.36 -12.07 C 23.83 -6.16 C 20.66 -9.85 C 20.66 -11.31 44 1 -1 46 2 -2 47 3 -2 4 28 1 43 5 -1 45 6 -2 48 7 -1 49 8 -1 9 34 2 39 10 -2 40 11 -2 12 17 1 12 35 2 13 14 1 13 36 2 14 37 2 15 36 1 15 38 2 16 29 1 16 30 1 17 48 1 18 20 1 18 44 1 19 21 1 19 46 1 20 52 1 21 51 1 22 32 1 22 43 1 23 31 1 23 45 1 24 35 1 24 41 1 25 39 1 25 47 1 26 43 1 50 26 -1 51 27 -2 52 27 -2 43 28 -2 29 37 1 30 38 1 31 41 1 50 32 -2 33 34 1 33 50 1 34 42 1 35 45 1 41 36 -2 37 38 1 39 49 1 40 42 1 40 50 1 42 44 1 44 51 1 45 47 1 46 48 1 46 49 1 47 48 1 49 52 1 51 52 1', '52 61 H 21.33 -8.73 H 18.07 -12.36 H 16.75 -14.68 C:51 27.24 -7.59 C:19 27.14 -4.77 C:24 15.47 -12.89 C:17 16.75 -10.60 C:20 19.36 -10.60 O 20.26 -6.86 O 20.55 -14.29 O 24.95 -8.43 C:118 14.26 -12.07 C:119 11.82 -17.78 C:108 10.61 -18.49 C:107 10.61 -15.69 C:101 7.25 -17.08 C:40 15.47 -11.31 C:22 22.86 -10.60 C:16 18.07 -9.85 C:26 22.03 -11.74 C:25 19.36 -9.13 C:77 25.14 -4.34 C:73 15.47 -15.69 C:41 13.05 -14.29 C:24 18.07 -14.29 C:45 25.14 -6.60 C:14 21.48 -10.60 O 27.24 -6.16 O 8.07 -18.21 O 8.07 -15.95 O 14.26 -16.38 O 23.83 -4.77 O 22.49 -5.72 C:175 21.65 -6.86 C:140 14.26 -13.58 C:137 11.82 -16.38 C:147 9.40 -17.78 C:148 9.40 -16.38 C:74 19.36 -13.58 C:72 23.83 -7.59 C:82 13.05 -15.69 C:42 22.49 -8.02 C:83 25.99 -5.48 C:47 22.03 -9.42 C:38 15.47 -14.29 C:44 18.07 -11.31 C:44 16.75 -13.58 C:37 16.75 -12.07 C:38 19.36 -12.07 C:112 23.83 -6.16 C:26 20.66 -9.85 C:34 20.66 -11.31 44 1 -1 46 2 -2 47 3 -2 4 28 1 43 5 -1 45 6 -2 48 7 -1 49 8 -1 9 34 2 39 10 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