Mol:FL2FA9GS0005
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 43 47 0 0 0 0 0 0 0 0999 V2000 0.1416 1.3679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1416 0.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8426 0.1538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5436 0.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5436 1.3679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8426 1.7728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2447 0.1538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9457 0.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9457 1.3679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2447 1.7728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6465 1.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3610 1.3601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0756 1.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0756 2.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3610 3.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6465 2.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2447 -0.5315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5592 1.7726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8426 -0.6554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8472 1.3050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4984 1.9564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2986 1.5002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2195 1.5002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5683 0.8488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7681 1.3050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3081 0.8475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7681 1.2851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0141 0.7985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3683 -0.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8796 -0.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8194 -0.3291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7651 -0.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2539 -0.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3139 -0.6384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5268 -0.1365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7584 -0.6156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9462 -1.3676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9462 -2.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9462 -3.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1965 -2.1349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3813 -1.6398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8703 1.9113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0756 2.2794 0.0000 O 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 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 1 18 1 0 0 0 0 3 19 1 0 0 0 0 20 18 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 1 0 0 0 24 25 1 1 0 0 0 20 25 1 1 0 0 0 24 26 1 0 0 0 0 23 27 1 0 0 0 0 25 28 1 0 0 0 0 30 29 1 1 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 1 0 0 0 29 34 1 1 0 0 0 28 30 1 0 0 0 0 32 35 1 0 0 0 0 33 36 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 40 2 0 0 0 0 29 41 1 0 0 0 0 34 37 1 0 0 0 0 42 43 1 0 0 0 0 22 42 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 42 43 M SBL 1 1 47 M SMT 1 ^ CH2OH M SBV 1 47 0.5717 -0.4110 S SKP 5 ID FL2FA9GS0005 FORMULA C29H34O14 EXACTMASS 606.194855796 AVERAGEMASS 606.57186 SMILES C(C(C)1)(C(OC(C)=O)C(C(OC(C5O)C(OC(C5O)CO)Oc(c4)cc(O2)c(c(O)4)C(CC(c(c3)cccc3)2)=O)O1)O)O M END
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