Mol:LBGPxkkp:16402BC01:16402BC01:OPP--0002
58 54 0 0 0 0 0 0 0 0999 V2000 -1.1738 -1.6041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6525 -1.6143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3671 1.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3671 -0.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2413 -0.3327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3671 -1.6244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4183 1.2544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7204 -1.6244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7204 -1.9284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -1.6244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -1.9284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6525 -0.3327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5967 -1.6244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5967 -1.9284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 -1.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3162 -1.6244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0073 -1.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4302 -1.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1467 -1.6244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8496 -1.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2945 -1.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0178 -1.6244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2827 -1.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8869 -1.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6285 -1.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 -1.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2413 -1.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 -1.9504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 1.2544 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 0.0755 1.2544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 1.9504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 0.3989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1569 -0.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7373 -0.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7373 -0.6553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -0.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -0.6553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5797 -0.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5797 -0.6553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 -0.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3162 -0.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0243 -0.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4472 -0.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1636 -0.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8666 -0.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3114 -0.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0009 -0.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2657 -0.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8699 -0.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 -1.4411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8356 -1.6788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 -0.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6285 -0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 -0.3752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2413 -0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 -0.6773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 -0.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8356 -0.4057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 4 5 1 1 8 9 1 0 10 11 1 0 4 12 1 1 13 14 1 0 15 16 1 0 16 17 1 0 8 17 1 0 8 18 2 0 18 19 1 0 19 20 1 0 10 20 1 0 10 21 2 0 21 22 1 0 22 23 1 0 13 23 1 0 13 24 2 0 1 24 1 0 25 26 1 0 26 27 1 0 26 28 1 0 7 29 1 0 29 30 1 0 29 31 2 0 29 32 1 0 34 35 1 0 36 37 1 0 38 39 1 0 40 41 1 0 41 42 1 0 34 42 1 0 34 43 2 0 43 44 1 0 44 45 1 0 36 45 1 0 36 46 2 0 46 47 1 0 47 48 1 0 38 48 1 0 38 49 2 0 33 49 1 0 12 33 1 0 15 26 1 0 3 4 1 0 4 6 1 0 2 6 1 0 3 7 1 0 50 51 1 0 53 54 1 0 54 55 1 0 54 56 1 0 52 54 1 0 57 58 1 0
S SKP 5 ID LBGPxkkp:16402BC01:16402BC01:OPP--0002:01 FORMULA C50H97O6P EXACTMASS 824.7022773460001 AVERAGEMASS 825.2753409999999 SMILES CC(CCC)=CCCC(C)=CCCC(=CCOC(COCC=C(C)CCC=C(CCC=C(C)CCCC(C)(C)C)C)(COP(O)(O)=O)[H])C M END
