Mol:FL5FADGS0027
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 64 70 0 0 0 0 0 0 0 0999 V2000 3.0297 1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3152 1.7152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3152 2.5401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0297 2.9526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7442 2.5401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7442 1.7152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6007 1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8863 1.7152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1719 1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1719 0.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8863 0.0652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6007 0.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5426 1.7152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 0.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5426 0.0652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8863 -0.7598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 1.7138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4197 0.0020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5426 -0.7598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4585 2.9526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0297 3.7776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7539 4.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -2.1821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3872 -2.1882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6111 -1.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2086 -0.8246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3833 -0.8184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1593 -1.6127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -1.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5524 -3.0336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -2.7473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5825 -1.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0221 -2.0659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5532 -2.9124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9321 -3.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1501 -3.3821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3429 -3.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0788 -2.8016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -3.0842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4318 -3.5628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2223 -3.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -3.9495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3091 -4.1957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -2.6196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7745 -3.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3349 -2.8387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1257 -2.6029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1072 -1.7778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5468 -2.3836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5299 -3.1319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2296 -3.6663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2266 -3.6247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3181 -3.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5497 0.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9623 0.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1688 0.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3705 0.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9579 0.9861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7513 0.7594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3752 -0.3852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6642 -0.1432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4585 0.3836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2429 0.8858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 12 19 1 0 0 0 0 16 20 1 0 0 0 0 5 21 1 0 0 0 0 4 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 1 0 0 0 25 26 1 1 0 0 0 27 26 1 1 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 24 1 0 0 0 0 26 30 1 0 0 0 0 24 31 1 0 0 0 0 25 32 1 0 0 0 0 29 33 1 0 0 0 0 33 34 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 1 0 0 0 38 37 1 1 0 0 0 39 38 1 1 0 0 0 39 40 1 0 0 0 0 40 35 1 0 0 0 0 36 41 1 0 0 0 0 35 42 1 0 0 0 0 37 43 1 0 0 0 0 38 44 1 0 0 0 0 34 39 1 0 0 0 0 27 19 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 1 0 0 0 48 47 1 1 0 0 0 49 48 1 1 0 0 0 49 50 1 0 0 0 0 50 45 1 0 0 0 0 48 51 1 0 0 0 0 47 52 1 0 0 0 0 46 53 1 0 0 0 0 45 54 1 0 0 0 0 49 30 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 1 0 0 0 58 57 1 1 0 0 0 59 58 1 1 0 0 0 59 60 1 0 0 0 0 60 55 1 0 0 0 0 58 61 1 0 0 0 0 57 62 1 0 0 0 0 56 63 1 0 0 0 0 55 64 1 0 0 0 0 59 18 1 0 0 0 0 S SKP 5 ID FL5FADGS0027 FORMULA C40H52O24 EXACTMASS 916.284852592 AVERAGEMASS 916.82648 SMILES OC(C(O)2)C(OC(OC(=C(c(c7)cc(c(c7)O)OC)4)C(=O)c(c6O)c(cc(c6)OC(C(O)5)OC(C)C(O)C(O)5)O4)C2OC(C3O)OC(C)C(C3O)O)COC(O1)C(O)C(C(O)C(C)1)O M END