Mol:LBPR02010002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 58 58 0 0 0 0 0 0 0 0999 V2000 -11.9646 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6796 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6796 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9646 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2510 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2510 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9646 1.6514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9646 -1.6514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.3946 -0.8264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2296 0.8264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5360 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5360 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8237 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1101 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3965 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6829 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9693 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2556 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5420 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1101 1.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2556 1.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2196 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2196 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0711 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3566 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6421 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9277 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2132 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4987 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7843 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0698 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6447 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3592 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0736 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7881 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5026 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9315 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6460 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3605 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0749 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7894 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5039 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2183 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9328 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6473 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3618 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0762 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7907 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5052 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2196 0.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6421 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7843 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0736 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9315 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7894 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6473 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5052 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 1 6 1 0 0 0 0 1 7 2 0 0 0 0 4 8 2 0 0 0 0 3 9 1 0 0 0 0 2 10 1 0 0 0 0 5 11 1 0 0 0 0 6 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 14 20 1 0 0 0 0 18 21 1 0 0 0 0 10 22 1 0 0 0 0 9 23 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 2 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 2 0 0 0 0 50 51 1 0 0 0 0 26 52 1 0 0 0 0 30 53 1 0 0 0 0 34 54 1 0 0 0 0 38 55 1 0 0 0 0 42 56 1 0 0 0 0 46 57 1 0 0 0 0 50 58 1 0 0 0 0 19 24 1 0 0 0 0 S SKP 5 ID LBPR02010002 FORMULA C54H82O4 EXACTMASS 794.6213111120001 AVERAGEMASS 795.22648 SMILES C(C=C(CCC=C(C)CCC=C(CCC=C(C)C)C)C)CC(=CCCC(=CCCC(C)=CCCC(=CCCC(=CCc(c(C)1)c(=O)c(c(OC)c(=O)1)OC)C)C)C)C M END