Mol:LBGPxkkp:18109SC01:18109SC01:CPYCT0008
72 68 0 0 0 0 0 0 0 0999 V2000 -4.2210 -4.7832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5487 3.5717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6068 -1.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1029 -1.9916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6068 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1513 -1.9916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1513 3.5717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6523 3.5717 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.1359 3.5717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6523 4.7628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6523 2.1076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4968 3.5717 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 0.4968 4.8209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4968 2.1076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7133 1.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2101 -1.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3554 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0016 3.5717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4126 2.8597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2217 0.1641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9241 0.1641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4470 1.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0701 2.2789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6902 1.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2217 -0.6348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0694 -0.6058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3018 4.1295 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3018 3.0837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2053 2.5608 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1029 3.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1029 4.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2053 4.6466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9241 2.7351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2053 5.2916 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7934 -1.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8041 -1.9652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7852 -1.9652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3102 -2.4650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2601 -2.4650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7948 -1.9652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2478 -2.4650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2821 -2.4650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9035 -1.9652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5665 -1.9652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1394 -2.4650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3836 -1.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8506 -2.4854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -1.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8686 -2.4854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1133 -2.4854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3154 -1.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7424 -2.3808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -1.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6481 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6589 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -5.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1148 -5.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6495 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1025 -5.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1368 -5.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7583 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4212 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0059 -5.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5288 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9959 -5.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5193 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0138 -5.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -5.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4607 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8906 -5.1872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3002 -4.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3 4 1 1 3 5 1 0 7 8 1 0 8 9 1 0 8 10 2 0 8 11 1 0 12 13 2 0 12 14 1 0 6 16 1 0 1 17 1 0 3 2 1 0 3 6 1 1 1 5 1 0 9 12 1 0 2 7 1 0 12 18 1 0 15 19 1 0 18 19 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 20 24 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 31 32 1 0 27 32 1 0 22 29 1 0 28 33 2 0 32 34 1 0 20 25 1 0 21 26 1 0 36 38 1 0 36 39 1 0 39 40 1 0 40 41 1 0 37 41 1 0 37 42 1 0 35 42 1 0 43 44 2 0 38 43 1 0 44 45 1 0 47 48 1 0 48 49 1 0 46 49 1 0 46 50 1 0 47 51 1 0 51 52 1 0 52 53 1 0 55 57 1 0 55 58 1 0 58 59 1 0 59 60 1 0 56 60 1 0 56 61 1 0 54 61 1 0 62 63 2 0 57 62 1 0 63 64 1 0 66 67 1 0 67 68 1 0 65 68 1 0 65 69 1 0 66 70 1 0 70 71 1 0 71 72 1 0
M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 18 19 M SBL 1 2 16 17 M SMT 1 OCH2 M SBV 1 16 -1.5047 0.0000 M SBV 1 17 0.3007 -1.4784 S SKP 5 ID LBGPxkkp:18109SC01:18109SC01:CPYCT0008:01 FORMULA C53H111N3O13P2 EXACTMASS 1059.759213673 AVERAGEMASS 1060.408382 SMILES C(CC)CCCCCC=CC M END
