Mol:LBGPxpkk:R:16000BC12:16000BC12
(Redirected from Mol:LBGPxpkk:R:16000BC12:16000BC12:01)
64 64 0 0 0 0 0 0 0 0999 V2000 -1.8842 1.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3323 1.8842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 1.9113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0809 0.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8702 0.8503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0809 -0.9845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2576 -0.9845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3663 0.8503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3987 -0.9845 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.5195 -0.9845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3987 -0.2955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3987 -1.8469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 0.8690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4883 1.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4883 1.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9606 1.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9606 1.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4329 1.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4329 1.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0931 1.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0931 1.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8702 2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1064 2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7244 1.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3425 2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5787 2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1984 1.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8148 2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0814 2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 1.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6807 2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5108 2.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4544 0.8403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4544 0.4413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9266 0.8403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9266 0.4413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3989 0.8403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1271 0.8403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1271 0.4413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8363 1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0724 1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6905 0.8403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3086 1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5447 1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1645 0.8403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7808 1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0475 1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 0.8403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7147 1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5108 1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3989 0.4413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0662 -0.9863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5924 -2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0951 -2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1545 -1.8537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0951 -1.4174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5924 -1.4174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -1.8537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8674 -1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1169 -0.9863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8674 -0.5501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -0.5501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1205 -0.9863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 4 5 1 1 4 6 1 0 7 9 1 0 9 10 1 0 9 11 2 0 9 12 1 0 8 13 1 0 14 15 1 0 16 17 1 0 18 19 1 0 20 21 1 0 14 22 1 0 14 23 1 0 23 24 1 0 24 25 1 0 16 25 1 0 16 26 1 0 26 27 1 0 27 28 1 0 18 28 1 0 18 29 1 0 29 30 1 0 30 31 1 0 20 31 1 0 33 34 1 0 35 36 1 0 38 39 1 0 33 40 1 0 33 41 1 0 41 42 1 0 42 43 1 0 35 43 1 0 35 44 1 0 44 45 1 0 45 46 1 0 37 46 1 0 37 47 1 0 47 48 1 0 48 49 1 0 38 49 1 0 38 50 1 0 37 51 1 0 10 52 1 0 13 50 1 0 2 3 1 0 4 3 1 0 4 8 1 1 6 7 1 0 53 54 2 0 54 55 1 0 55 56 2 0 56 57 1 0 57 58 2 0 53 58 1 0 12 58 1 0 1 32 1 0 20 32 1 0 59 60 2 0 60 61 1 0 61 62 2 0 62 63 1 0 63 64 2 0 59 64 1 0
S SKP 5 ID LBGPxpkk:R:16000BC12:16000BC12:01 FORMULA C56H101O6P EXACTMASS 900.733577474 AVERAGEMASS 901.3713009999999 SMILES C(CC(C)CCCC(C)CCCC(C)C)CC(CCOC([H])(COCCC(C)CCCC(CCCC(CCCC(C)C)C)C)COP(OC)(Oc(c1)cccc1)=O)C M END
