Mol:FL6DADGS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 33 36 0 0 0 0 0 0 0 0999 V2000 -2.4939 0.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4939 -0.7342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7793 -1.1467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0649 -0.7342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0649 0.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7793 0.5033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3503 -1.1467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3641 -0.7342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3641 0.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3503 0.5033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0784 0.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8066 0.0827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5348 0.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5348 1.3441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8066 1.7645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0784 1.3441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3503 -1.9714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2066 0.5023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2066 1.7320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7793 -2.0553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -1.3300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7063 -2.6309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -3.0279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1758 -2.2645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -1.4963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7063 -1.0993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9244 -1.8627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8881 -1.8238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8658 -3.3225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4036 -3.6192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7323 -2.6579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8066 2.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3736 3.6192 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 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 6 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 7 17 1 0 0 0 0 18 1 1 0 0 0 0 14 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 1 0 0 0 23 22 1 1 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 1 0 0 0 27 22 1 1 0 0 0 27 28 1 0 0 0 0 22 29 1 0 0 0 0 23 30 1 0 0 0 0 24 31 1 0 0 0 0 26 21 1 0 0 0 0 32 33 1 0 0 0 0 15 32 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 32 33 M SBL 1 1 36 M SMT 1 OCH3 M SBV 1 36 0.0000 -0.7022 S SKP 5 ID FL6DADGS0001 FORMULA C22H26O11 EXACTMASS 466.147511674 AVERAGEMASS 466.43524 SMILES c(C(O)2)(c1O)c(OC(c(c4)cc(OC)c(O)c4)C2OC(O3)C(O)C(C(O)C(C)3)O)cc(c1)O M END