Mol:FL3FABGS0009
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 45 49 0 0 0 0 0 0 0 0999 V2000 -0.4042 -1.4652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4042 -2.2747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2966 -2.6793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9976 -2.2747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9976 -1.4652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2966 -1.0606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6984 -2.6793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3994 -2.2747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3994 -1.4652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6984 -1.0606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6984 -3.3104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1001 -1.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8145 -1.4731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 -1.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 -0.2359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8145 0.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1001 -0.2359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1049 -1.0607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2966 -3.3109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1839 -0.9453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5428 -1.7914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6198 -1.4325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7292 -1.4228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3764 -0.7754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1839 -1.2016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5365 -0.6088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8225 -1.2939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2107 -1.8207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9246 -2.0122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -0.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 -0.7889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1618 0.0782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 0.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 1.4016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4472 0.5345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2244 -0.6156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2366 2.0016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 1.5133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0452 0.9482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3534 -0.3718 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6590 2.7006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2960 2.7006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3069 3.3109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 0.1766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3534 -0.4645 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 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 12 1 0 0 0 0 1 18 1 0 0 0 0 19 3 1 0 0 0 0 20 21 1 1 0 0 0 21 22 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 20 1 0 0 0 0 25 26 1 0 0 0 0 20 27 1 0 0 0 0 21 28 1 0 0 0 0 22 29 1 0 0 0 0 31 30 1 1 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 1 0 0 0 35 30 1 1 0 0 0 31 36 1 0 0 0 0 36 26 1 0 0 0 0 34 37 1 0 0 0 0 33 38 1 0 0 0 0 35 39 1 0 0 0 0 30 40 1 0 0 0 0 23 18 1 0 0 0 0 37 41 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 44 45 1 0 0 0 0 15 44 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 44 45 M SBL 1 1 49 M SMT 1 OCH3 M SBV 1 49 -0.7140 -0.4124 S SKP 5 ID FL3FABGS0009 FORMULA C30H34O15 EXACTMASS 634.189770418 AVERAGEMASS 634.58196 SMILES C(O)(C(COC(C(O)5)OC(C)C(OC(C)=O)C5O)4)C(C(C(O4)Oc(c1)cc(O2)c(C(C=C2c(c3)ccc(c3)OC)=O)c1O)O)O M END
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