Mol:FL3F4AGS0001
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 44 48 0 0 0 0 0 0 0 0999 V2000 -0.1527 0.1971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1527 -0.6279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5617 -1.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2762 -0.6279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2762 0.1971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5617 0.6096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9906 -1.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7051 -0.6279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7051 0.1971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9906 0.6096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4195 0.6096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 0.1971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8484 0.6096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8484 1.4346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 1.8470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4195 1.4346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9906 -1.8653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5947 1.8653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8723 0.5441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5617 1.3365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2344 1.4961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8705 -1.0423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5442 0.1561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6442 -0.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2316 -1.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4332 -1.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6397 -1.2512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0523 -0.5365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8507 -0.7456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9658 -1.5597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1656 -0.6745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7383 -1.1631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1546 -0.3131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8783 -0.1277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 0.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0164 1.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5545 0.4844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5055 -0.3394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6981 -0.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1599 0.1741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0654 1.7843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5180 1.4946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2344 0.6874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0470 -0.5873 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 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 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 7 17 2 0 0 0 0 14 18 1 0 0 0 0 19 1 1 0 0 0 0 6 20 1 0 0 0 0 18 21 1 0 0 0 0 2 22 1 0 0 0 0 19 23 1 0 0 0 0 24 25 1 1 0 0 0 25 26 1 1 0 0 0 27 26 1 1 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 24 1 0 0 0 0 26 30 1 0 0 0 0 24 31 1 0 0 0 0 25 32 1 0 0 0 0 29 33 1 0 0 0 0 33 34 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 36 41 1 0 0 0 0 35 42 1 0 0 0 0 37 43 1 0 0 0 0 38 44 1 0 0 0 0 34 39 1 0 0 0 0 27 22 1 0 0 0 0 S SKP 5 ID FL3F4AGS0001 FORMULA C29H34O15 EXACTMASS 622.189770418 AVERAGEMASS 622.5712599999999 SMILES c(c5OC)(cc(c(c(O)5)4)C(=O)C=C(O4)c(c3)ccc(OC)c3)OC(C(O)1)OC(COC(O2)C(C(C(O)C(C)2)O)O)C(O)C(O)1 M END
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