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<p></p> <p><b>New page</b></p><div>&lt;pre&gt;<br /> <br /> Copyright: ARM project http://www.metabolome.jp/<br /> 34 37 0 0 0 0 0 0 0 0999 V2000<br /> -0.8097 0.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.8097 -0.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.2534 -0.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.3029 -0.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.3029 0.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.2534 0.4531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.8592 -0.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.4155 -0.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.4155 0.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.8592 0.4531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.8592 -1.8316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.9716 0.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.5386 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.1056 0.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.1056 1.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.5386 1.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.9716 1.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.3658 0.4530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.2534 -1.4737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.0890 0.4207 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0<br /> -3.5734 -0.2599 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -2.8309 0.0288 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -2.1145 0.0366 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -2.6351 0.5573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.2847 0.2145 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> -4.4538 0.6314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.3772 -0.2990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.4055 -0.6853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.7395 1.4737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.4540 1.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.8140 -1.3422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2461 -2.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.4850 1.0967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7512 1.7760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1 2 1 0 0 0 0<br /> 2 3 2 0 0 0 0<br /> 3 4 1 0 0 0 0<br /> 4 5 2 0 0 0 0<br /> 5 6 1 0 0 0 0<br /> 6 1 2 0 0 0 0<br /> 4 7 1 0 0 0 0<br /> 7 8 1 0 0 0 0<br /> 8 9 2 0 0 0 0<br /> 9 10 1 0 0 0 0<br /> 10 5 1 0 0 0 0<br /> 7 11 2 0 0 0 0<br /> 9 12 1 0 0 0 0<br /> 12 13 2 0 0 0 0<br /> 13 14 1 0 0 0 0<br /> 14 15 2 0 0 0 0<br /> 15 16 1 0 0 0 0<br /> 16 17 2 0 0 0 0<br /> 17 12 1 0 0 0 0<br /> 1 18 1 0 0 0 0<br /> 3 19 1 0 0 0 0<br /> 20 21 1 1 0 0 0<br /> 21 22 1 1 0 0 0<br /> 23 22 1 1 0 0 0<br /> 23 24 1 0 0 0 0<br /> 24 25 1 0 0 0 0<br /> 25 20 1 0 0 0 0<br /> 20 26 1 0 0 0 0<br /> 21 27 1 0 0 0 0<br /> 22 28 1 0 0 0 0<br /> 23 18 1 0 0 0 0<br /> 15 29 1 0 0 0 0<br /> 29 30 1 0 0 0 0<br /> 8 31 1 0 0 0 0<br /> 31 32 1 0 0 0 0<br /> 25 33 1 0 0 0 0<br /> 33 34 1 0 0 0 0<br /> M STY 1 3 SUP<br /> M SLB 1 3 3<br /> M SAL 3 2 33 34<br /> M SBL 3 1 36<br /> M SMT 3 CH2OH<br /> M SVB 3 36 -3.485 1.0967<br /> M STY 1 2 SUP<br /> M SLB 1 2 2<br /> M SAL 2 2 31 32<br /> M SBL 2 1 34<br /> M SMT 2 OCH3<br /> M SVB 2 34 1.814 -1.3422<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 29 30<br /> M SBL 1 1 32<br /> M SMT 1 OCH3<br /> M SVB 1 32 3.7395 1.4737<br /> S SKP 8<br /> ID FL5FDBGS0001<br /> KNApSAcK_ID C00005298<br /> NAME Ermanin 7-glucoside<br /> CAS_RN 41756-09-6<br /> FORMULA C23H24O11<br /> EXACTMASS 476.13186161<br /> AVERAGEMASS 476.43006<br /> SMILES c(c1)(O3)c(C(C(OC)=C3c(c4)ccc(OC)c4)=O)c(O)cc1O[C@@H]([C@H]2O)OC(CO)[C@@H]([C@@H]2O)O<br /> M END<br /> &lt;/pre&gt;</div>

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