Mol:FL3FAEGS0012
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 53 58 0 0 0 0 0 0 0 0999 V2000 3.3340 0.8468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 0.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0485 -0.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 0.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 0.8468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0485 1.2593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6196 -0.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9051 0.0218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1906 -0.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1906 -1.2157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9051 -1.6282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6196 -1.2157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4761 0.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2383 -0.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2383 -1.2157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4761 -1.6282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9051 -2.3464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9528 0.0218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4761 -2.3141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4685 1.2484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3374 -0.3098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1703 0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1280 2.0886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9425 2.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4483 1.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3597 0.7389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5452 0.6076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0394 1.2683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0212 0.5635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1703 1.7602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9202 2.7534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3327 2.6007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4593 -1.4001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8718 -2.1145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0785 -1.8878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2805 -2.0970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8679 -1.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6612 -1.6092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2232 -2.7534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4502 -2.5321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2804 -1.9585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1936 -1.4828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6655 0.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -0.1815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4549 0.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6617 -0.1992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0741 0.5153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8723 0.3063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2754 0.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7963 0.8994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1884 0.3166 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -0.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0062 -0.6342 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 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 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 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 16 19 1 0 0 0 0 5 20 1 0 0 0 0 4 21 1 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 1 0 0 0 26 25 1 1 0 0 0 27 26 1 1 0 0 0 27 28 1 0 0 0 0 28 23 1 0 0 0 0 26 29 1 0 0 0 0 25 30 1 0 0 0 0 24 31 1 0 0 0 0 23 32 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 1 0 0 0 36 35 1 1 0 0 0 37 36 1 1 0 0 0 37 38 1 0 0 0 0 38 33 1 0 0 0 0 36 39 1 0 0 0 0 35 40 1 0 0 0 0 34 41 1 0 0 0 0 33 42 1 0 0 0 0 43 44 1 1 0 0 0 44 45 1 1 0 0 0 46 45 1 1 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 43 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 43 51 1 0 0 0 0 44 52 1 0 0 0 0 45 53 1 0 0 0 0 46 18 1 0 0 0 0 37 53 1 0 0 0 0 27 50 1 0 0 0 0 S SKP 5 ID FL3FAEGS0012 FORMULA C34H42O19 EXACTMASS 754.2320291619999 AVERAGEMASS 754.68588 SMILES c(c6)c(cc(c(OC)6)O)C(O1)=CC(=O)c(c5O)c(cc(c5)OC(C3OC(O4)C(O)C(O)C(C4C)O)OC(C(C3O)O)COC(C2O)OC(C)C(C2O)O)1 M END
</pre>