Mol:LBG00-kk::16114BC01:16114BC01
48 46 0 0 0 0 0 0 0 0999 V2000 -2.4350 0.8936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -0.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2243 -0.1333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7034 -0.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1569 -0.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7373 -0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7373 -0.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -0.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5797 -0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5797 -0.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3162 -0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0243 0.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4472 0.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1636 -0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8666 0.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3114 0.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0009 -0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2657 0.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8699 0.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6455 0.1824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 -0.1079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2243 0.1824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 -0.4100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6864 -1.1704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1229 0.8936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7713 0.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7713 0.5796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 0.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 0.5796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5458 0.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5458 0.5796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6455 1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3501 0.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0583 1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4811 1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1976 0.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9005 1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3454 1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0331 0.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2317 1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8359 1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7101 0.8936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6455 1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 0.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2243 1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 0.5796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 1 2 5 1 1 7 8 1 0 9 10 1 0 11 12 1 0 13 14 1 0 7 14 1 0 7 15 1 0 15 16 1 0 16 17 1 0 9 17 1 0 9 18 1 0 18 19 1 0 19 20 1 0 11 20 1 0 11 21 2 0 6 21 1 0 22 23 1 0 23 24 1 0 23 25 1 0 5 6 1 0 28 29 1 0 30 31 1 0 32 33 1 0 34 35 1 0 35 36 1 0 28 36 1 0 28 37 1 0 37 38 1 0 38 39 1 0 30 39 1 0 30 40 1 0 40 41 1 0 41 42 1 0 32 42 1 0 32 43 2 0 27 43 1 0 13 22 1 0 2 1 1 0 2 4 1 0 1 44 1 0 44 27 1 0 4 26 1 0 45 46 1 0 46 47 1 0 46 48 1 0
S SKP 5 ID LBG00-kk::16114BC01:16114BC01:01 FORMULA C44H88O3 EXACTMASS 664.673346682 AVERAGEMASS 665.16772 SMILES C([H])(CO)(OCC=C(C)CCCC(CCCC(C)CCCC(C)C)C)COCC=C(CCCC(C)CCCC(C)CCC)C M END
