Mol:FL7AAGGL0062
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 65 71 0 0 0 0 0 0 0 0999 V2000 -0.3696 2.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3696 1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3448 1.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0593 1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0593 2.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3448 2.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7738 1.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4881 1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4881 2.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7738 2.8000 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 3.2647 2.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9792 2.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6936 2.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6936 3.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9792 4.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2648 3.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3338 4.0305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3467 1.0669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9496 2.7224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2126 0.3991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9791 4.8046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3586 2.4519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9255 -1.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6421 -1.1982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4364 -0.3989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6669 0.3935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9503 -0.0158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1557 -0.8151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5732 -1.1536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1588 -2.2480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6742 -1.9389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0306 0.1172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3547 -2.1440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -2.9008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4959 -2.3957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8059 -3.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5249 -4.1693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2329 -3.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2218 -2.9232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9308 -2.5013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6506 -2.9040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6616 -3.7288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9529 -4.1508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3586 -2.4825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7177 -2.2777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0576 -1.9952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0098 -1.1726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3514 -0.4305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4241 -0.7128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3568 -1.5354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0199 -1.7355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1264 -2.4282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5721 -2.9416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1297 -2.6409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8538 -1.0133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9917 -3.7809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2053 -4.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6059 -3.8567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3183 -3.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -2.6429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7041 -3.3643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7693 -3.8929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7645 -4.6635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5096 -4.8046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5012 -4.3395 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 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 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 5 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 8 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 15 21 1 0 0 0 0 13 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 28 29 1 0 0 0 0 23 30 1 0 0 0 0 24 31 1 0 0 0 0 25 32 1 0 0 0 0 26 18 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 43 38 1 0 0 0 0 41 44 1 0 0 0 0 33 29 1 0 0 0 0 45 46 1 1 0 0 0 46 47 1 1 0 0 0 48 47 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 45 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 45 53 1 0 0 0 0 46 54 1 0 0 0 0 47 55 1 0 0 0 0 48 20 1 0 0 0 0 34 52 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 1 0 0 0 59 58 1 1 0 0 0 60 59 1 1 0 0 0 60 61 1 0 0 0 0 61 56 1 0 0 0 0 59 62 1 0 0 0 0 58 63 1 0 0 0 0 57 64 1 0 0 0 0 56 65 1 0 0 0 0 60 33 1 0 0 0 0 M CHG 1 10 1 S SKP 5 ID FL7AAGGL0062 FORMULA C42H47O23 EXACTMASS 919.25081281 AVERAGEMASS 919.8087800000001 SMILES O(C(Oc(c3)c(c5)c([o+1]c(c5OC(O6)C(C(C(O)C6COC(O7)C(C(C(O)C7C)O)O)O)O)c(c4)cc(c(c4O)O)O)cc3O)1)C(COC(=O)C=Cc(c2)ccc(O)c2)C(O)C(O)C1O M END