Mol:FL7AAIGL0033
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 89 97 0 0 0 0 0 0 0 0999 V2000 -1.2369 4.3722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5125 4.7904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5125 5.6269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2369 6.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9613 5.6269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9613 4.7904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2118 4.3722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9362 4.7904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9362 5.6269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2118 6.0451 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 1.7026 6.0694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3878 5.6738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 6.0694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 6.8605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3878 7.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7026 6.8605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6926 7.2183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6375 6.0173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2369 3.7951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7639 4.1999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3878 7.8923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0021 8.5066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6976 5.7087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9837 4.0278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3164 3.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4257 3.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 3.4596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1013 4.3966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9921 3.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6676 4.6441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0918 5.0724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8536 3.6851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9052 3.2648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9311 2.6796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0291 4.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2318 3.5178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2179 3.3906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0017 2.7786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 3.3728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8129 3.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3683 4.3693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2588 3.9461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3848 2.8743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7858 2.6947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8889 1.9179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5264 0.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3029 -0.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1372 0.1139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1308 0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3543 1.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5199 0.5822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3066 -0.6197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -0.7984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8715 0.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5602 -0.3461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9891 0.4635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4386 1.2420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2814 0.4635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7421 -0.0756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1306 -0.0756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5307 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3307 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7308 -0.0756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3307 -0.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5307 -0.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4377 -0.0756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5506 -3.4304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7692 -2.8153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -1.8992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -0.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8034 -1.5290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4167 -2.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -1.2804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3386 -4.0962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8486 -3.7561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 -3.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8968 -4.1493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8355 -4.1421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3594 -3.4533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1717 -4.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6954 -5.6338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1474 -6.3763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9724 -6.3763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3848 -7.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9724 -7.8052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1474 -7.8052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7349 -7.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3624 -8.5066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3952 6.1116 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 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 3 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 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 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 5 18 1 0 0 0 0 1 19 1 0 0 0 0 8 20 1 0 0 0 0 15 21 1 0 0 0 0 21 22 1 0 0 0 0 13 23 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 1 0 0 0 27 26 1 1 0 0 0 28 27 1 1 0 0 0 28 29 1 0 0 0 0 29 24 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 24 32 1 0 0 0 0 25 33 1 0 0 0 0 26 34 1 0 0 0 0 19 27 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 20 36 1 0 0 0 0 35 41 1 0 0 0 0 40 42 1 0 0 0 0 39 43 1 0 0 0 0 38 44 1 0 0 0 0 44 45 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 1 0 0 0 49 48 1 1 0 0 0 50 49 1 1 0 0 0 50 51 1 0 0 0 0 51 46 1 0 0 0 0 45 50 1 0 0 0 0 49 52 1 0 0 0 0 48 53 1 0 0 0 0 46 54 1 0 0 0 0 47 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 2 0 0 0 0 56 58 1 0 0 0 0 58 59 2 0 0 0 0 59 60 1 0 0 0 0 60 61 2 0 0 0 0 61 62 1 0 0 0 0 62 63 2 0 0 0 0 63 64 1 0 0 0 0 64 65 2 0 0 0 0 65 60 1 0 0 0 0 63 66 1 0 0 0 0 67 68 1 1 0 0 0 68 69 1 1 0 0 0 70 69 1 1 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 72 67 1 0 0 0 0 69 73 1 0 0 0 0 67 74 1 0 0 0 0 68 75 1 0 0 0 0 66 70 1 0 0 0 0 72 76 1 0 0 0 0 76 77 1 0 0 0 0 77 78 1 0 0 0 0 78 79 2 0 0 0 0 78 80 1 0 0 0 0 80 81 2 0 0 0 0 81 82 1 0 0 0 0 82 83 2 0 0 0 0 83 84 1 0 0 0 0 84 85 2 0 0 0 0 85 86 1 0 0 0 0 86 87 2 0 0 0 0 87 82 1 0 0 0 0 85 88 1 0 0 0 0 23 89 1 0 0 0 0 M CHG 1 10 1 S SKP 5 ID FL7AAIGL0033 FORMULA C59H67O30 EXACTMASS 1255.371715804 AVERAGEMASS 1256.14528 SMILES c(c9)(ccc(c9)O)C=CC(OCC(C8O)OC(C(C8O)O)Oc(c1)ccc(C=CC(OC(C(O)2)C(OC(OCC(C(O)3)OC(Oc(c6)c(c(c7)cc(OC)c(O)c7OC)[o+1]c(c64)cc(cc4OC(C5O)OC(C(C5O)O)CO)O)C(O)C3O)C2O)C)=O)c1)=O M END
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