Mol:LBF18207HP03
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 25 25 0 0 1 0 0 0 0 0999 V2000 -3.1763 1.1129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6263 1.1129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0656 1.1129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5935 1.1129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2185 0.8494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8533 1.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0023 1.5575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4591 1.5499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3949 1.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4301 1.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2352 1.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 0.3749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2352 -0.3748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -1.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2352 -1.8739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -2.6235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7638 0.7119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4266 0.3749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4266 1.8740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9938 2.6235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0664 1.4903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3169 1.9230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -0.5141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1763 -0.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4619 -0.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 4 0 0 0 6 5 1 4 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 4 8 1 0 0 0 0 6 23 1 0 0 0 0 10 9 1 4 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 3 21 1 4 0 0 0 21 22 1 0 0 0 0 9 23 2 0 0 0 0 17 24 1 0 0 0 0 24 25 1 0 0 0 0 25 16 1 0 0 0 0 S SKP 5 ID LBF18207HP03 FORMULA C19H32O6 EXACTMASS 356.219888756 AVERAGEMASS 356.45378 SMILES C(O1)(CC(C=CC=CCCCCCCCC(=O)OC)O1)C(CC)OO M END
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