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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 /> 33 36 0 0 0 0 0 0 0 0999 V2000<br /> -1.0504 -3.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.6515 -3.7494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.1620 -3.5712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0716 -3.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.4706 -2.7236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.9600 -2.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.4178 -2.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5082 -2.3673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.1093 -2.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.3802 -2.2106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.8100 -2.9852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.1996 -1.5198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.6986 -1.3382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.7907 -0.8154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.3841 -0.4742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.1147 -0.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.2070 -1.1786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2361 -3.9053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.0268 0.2919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.5389 -3.5924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.4937 1.3006 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> 1.1060 0.6292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 1.8515 0.8423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.6015 0.6292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 2.9892 1.3006 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 2.2437 1.0876 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> 0.7737 1.1077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.5506 1.6193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.5486 0.9777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.3847 -0.1294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.8409 0.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.1137 0.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.8281 0.2434 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 /> 3 18 1 0 0 0 0<br /> 19 15 1 0 0 0 0<br /> 1 20 1 0 0 0 0<br /> 21 22 1 0 0 0 0<br /> 22 23 1 1 0 0 0<br /> 23 24 1 1 0 0 0<br /> 25 24 1 1 0 0 0<br /> 25 26 1 0 0 0 0<br /> 26 21 1 0 0 0 0<br /> 21 27 1 0 0 0 0<br /> 26 28 1 0 0 0 0<br /> 25 29 1 0 0 0 0<br /> 22 19 1 0 0 0 0<br /> 16 30 1 0 0 0 0<br /> 30 31 1 0 0 0 0<br /> 24 32 1 0 0 0 0<br /> 32 33 1 0 0 0 0<br /> M STY 1 2 SUP<br /> M SLB 1 2 2<br /> M SAL 2 2 32 33<br /> M SBL 2 1 35<br /> M SMT 2 CH2OH<br /> M SVB 2 35 3.1137 0.6559<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 30 31<br /> M SBL 1 1 33<br /> M SMT 1 OCH3<br /> M SVB 1 33 -0.4333 1.2835<br /> S SKP 8<br /> ID FL3FADGS0006<br /> KNApSAcK_ID C00004340<br /> NAME Luteolin 3'-methyl ether 4'-glucoside<br /> CAS_RN 36451-44-2<br /> FORMULA C22H22O11<br /> EXACTMASS 462.116211546<br /> AVERAGEMASS 462.40348000000006<br /> SMILES OC(C4O)[C@@H](O[C@H](CO)[C@@H]4O)Oc(c3)c(cc(c3)C(O2)=CC(c(c21)c(O)cc(O)c1)=O)OC<br /> M END<br /> &lt;/pre&gt;</div>

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