Mol:LBGDGcc-:18206SC05:18206SC05 2
46 45 0 0 0 0 0 0 0 0999 V2000 -6.9873 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1623 1.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9873 0.7706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9873 -0.0544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9873 -0.7706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9873 -1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1986 0.0036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4117 -0.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6976 0.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4117 -1.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7339 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0198 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3055 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5914 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8772 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 0.3580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1623 -1.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9471 -0.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2328 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5187 -0.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8045 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0522 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3762 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2012 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9153 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6296 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3437 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0578 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7721 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4862 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2005 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9146 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9795 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2653 -0.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4489 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2739 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -0.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7023 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4164 -0.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1305 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8448 -0.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5589 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2732 -0.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9873 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 8 9 1 0 8 10 2 0 2 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 11 17 2 0 6 18 1 0 7 8 1 0 19 20 1 0 20 21 1 0 21 22 1 0 9 19 1 0 16 23 2 0 23 24 1 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 22 35 2 0 35 36 1 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 4 7 1 0
S SKP 5 ID LBGDGcc-:18206SC05:18206SC05::02 FORMULA C41H72O5 EXACTMASS 644.5379754139999 AVERAGEMASS 645.0073799999999 SMILES C(CC=CCCCCCCCC)=CCCCCC(=O)OCCC(OC(=O)CCCCC=CCC=CCCCCCCCC)CCO M END
