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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 /> -2.8477 0.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.8477 -0.4145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2914 -0.7356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.7351 -0.4145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.7351 0.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2914 0.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1788 -0.7356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.6225 -0.4145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.6225 0.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1788 0.5491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1788 -1.2365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0664 0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5006 0.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.0675 0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.0675 1.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5006 1.5310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0664 1.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.4038 0.5490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.0256 -0.9647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.0710 -0.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.6834 -1.1448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.4288 -0.9317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.1788 -1.1448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.5665 -0.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.8210 -0.6863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.3439 -0.6682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.0856 -0.2281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.3305 0.4076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.6343 1.5309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7278 -0.8962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.0134 -1.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.6893 -1.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.4038 -1.5310 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 /> 20 21 1 0 0 0 0<br /> 21 22 1 1 0 0 0<br /> 24 23 1 1 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 /> 25 27 1 0 0 0 0<br /> 24 28 1 0 0 0 0<br /> 21 19 1 0 0 0 0<br /> 19 8 1 0 0 0 0<br /> 23 22 1 1 0 0 0<br /> 15 29 1 0 0 0 0<br /> 3 30 1 0 0 0 0<br /> 30 31 1 0 0 0 0<br /> 23 32 1 0 0 0 0<br /> 32 33 1 0 0 0 0<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 SBV 1 33 -5.6931 5.5330<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 SBV 2 35 -4.7462 5.7198<br /> S SKP 8<br /> ID FL5FBAGA0001<br /> KNApSAcK_ID C00005267<br /> NAME Kaempferol 5-methyl ether 3-galactoside<br /> CAS_RN 28454-84-4<br /> FORMULA C22H22O11<br /> EXACTMASS 462.116211546<br /> AVERAGEMASS 462.40348000000006<br /> SMILES c(c4)(ccc(c4)C(O2)=C(C(=O)c(c(OC)3)c2cc(c3)O)OC(O1)C(O)C(C(C(CO)1)O)O)O<br /> M END<br /> &lt;/pre&gt;</div>

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