Mol:LBF20303TX01
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Copyright: ARM project http://www.metabolome.jp/
25 26 0 0 0 0 0 0 0 0999 V2000 -2.3109 0.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3109 0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0253 -0.3996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7399 0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7399 0.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0253 1.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3698 1.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6553 0.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1697 0.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8843 1.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5988 0.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3133 1.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0278 0.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5988 -0.5126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8868 -0.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1747 -0.5126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5373 -0.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2494 -0.5126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0745 -0.5126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 -0.1001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5035 -0.5126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7399 1.3335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0278 0.2894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1747 -1.3349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0253 0.4255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 1 1 0 1 7 1 6 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 2 14 1 1 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 13 22 1 0 13 23 2 0 16 24 1 6 6 25 1 6 4 25 1 6
S SKP 6 ID LBF20403TX01 FORMULA C21H32O4 EXACTMASS 348.23005951199997 AVERAGEMASS 348.47637999999995 SMILES C([C@H]([C@H](C=C[C@H](O)CC=CCC)2)[C@@H](C1)O[C@H](C2)1)C=CCCCC(O)=O AUTODRAW FALSE M END