Mol:FL5FACGS0033
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 41 45 0 0 0 0 0 0 0 0999 V2000 -1.1344 0.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1344 -0.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4199 -0.7273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2946 -0.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2946 0.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4199 0.9228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0091 -0.7273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7237 -0.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7237 0.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0091 0.9228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0091 -1.3706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6234 1.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3515 0.6612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0798 1.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0798 1.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3515 2.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6234 1.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4199 -1.5521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8591 2.3724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4472 -0.8408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9879 1.0029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3515 3.1835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5928 1.0631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 0.4338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4295 0.7008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7671 0.7078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2484 1.1894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 0.8724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5914 1.7133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8591 0.3975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9729 0.2453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2425 -2.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9302 -2.5643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -1.8008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9302 -1.0326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2425 -0.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4608 -1.3991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -1.3991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4191 -2.8265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7644 -3.1835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3909 -2.1928 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 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 3 18 1 0 0 0 0 19 15 1 0 0 0 0 20 8 1 0 0 0 0 4 3 1 0 0 0 0 1 21 1 0 0 0 0 16 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 23 29 1 0 0 0 0 24 30 1 0 0 0 0 25 31 1 0 0 0 0 26 21 1 0 0 0 0 33 32 1 1 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 1 0 0 0 37 32 1 1 0 0 0 37 38 1 0 0 0 0 32 39 1 0 0 0 0 33 40 1 0 0 0 0 34 41 1 0 0 0 0 36 20 1 0 0 0 0 S SKP 5 ID FL5FACGS0033 FORMULA C26H28O15 EXACTMASS 580.1428202259999 AVERAGEMASS 580.49152 SMILES OC(C(O)5)C(OCC5O)Oc(c4)cc(O)c(c42)C(C(=C(c(c3)ccc(O)c3O)O2)OC(C(O)1)OC(C)C(C1O)O)=O M END
</pre>