Mol:FL5FACGS0087
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 64 70 0 0 0 0 0 0 0 0999 V2000 4.0579 2.6395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0579 1.8146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7723 1.4021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4867 1.8146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4867 2.6395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7723 3.0520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3434 1.4021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6289 1.8146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9146 1.4021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9146 0.5771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6289 0.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3434 0.5771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2001 1.8146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4856 1.4021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4856 0.5771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2001 0.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6289 -0.6604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2289 1.8146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0579 0.1646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2001 -0.6604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0786 2.9812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1153 1.4517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0331 1.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4278 0.9768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7268 1.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9018 1.4300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 1.9910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 1.5555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0542 0.9596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5151 1.0199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0331 0.8555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6522 1.8712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3665 1.8217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9581 2.5853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7798 2.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1365 1.9926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8463 1.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0246 1.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6679 1.8128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9562 3.0310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3647 2.9229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1153 2.1432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2761 0.8157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8721 -0.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4701 -1.6414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 -1.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0614 -1.6004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4636 -0.8798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6735 -1.1181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2292 -2.1914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8151 -2.0498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 -1.5070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1195 -1.0745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8414 -2.4318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1267 -2.8444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4602 -2.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2607 -2.0638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5461 -1.6512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0408 -2.2314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6333 -2.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2492 -2.4021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2644 -2.9076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7877 -3.0520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1706 -2.5355 0.0000 O 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 23 24 1 1 0 0 0 24 25 1 1 0 0 0 26 25 1 1 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 23 1 0 0 0 0 25 29 1 0 0 0 0 23 30 1 0 0 0 0 24 31 1 0 0 0 0 28 32 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 1 0 0 0 37 36 1 1 0 0 0 38 37 1 1 0 0 0 38 39 1 0 0 0 0 39 34 1 0 0 0 0 35 40 1 0 0 0 0 34 41 1 0 0 0 0 36 42 1 0 0 0 0 37 43 1 0 0 0 0 33 38 1 0 0 0 0 18 26 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 1 0 0 0 47 46 1 1 0 0 0 48 47 1 1 0 0 0 48 49 1 0 0 0 0 49 44 1 0 0 0 0 47 50 1 0 0 0 0 46 51 1 0 0 0 0 45 52 1 0 0 0 0 44 53 1 0 0 0 0 54 55 1 1 0 0 0 55 56 1 1 0 0 0 57 56 1 1 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 54 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 54 62 1 0 0 0 0 55 63 1 0 0 0 0 56 64 1 0 0 0 0 48 19 1 0 0 0 0 52 57 1 0 0 0 0 S SKP 5 ID FL5FACGS0087 FORMULA C39H50O25 EXACTMASS 918.26411715 AVERAGEMASS 918.7993 SMILES OC(C6O)C(COC(O7)C(C(O)C(O)C7C)O)OC(C6O)Oc(c5)cc(c3c5O)OC(c(c4)cc(c(c4)O)O)=C(C3=O)OC(O2)C(C(O)C(C(C)2)OC(C1O)OC(C(O)C1O)CO)O M END