Mol:FL1C1ANP0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 25 27 0 0 0 0 0 0 0 0999 V2000 1.4155 0.6384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4155 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9718 -0.3251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5281 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5281 0.6384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9718 0.9596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1585 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7148 -0.3251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3976 -0.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9585 0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3976 -0.9658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9585 0.6467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5111 0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0638 0.6467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0638 0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5111 -0.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5111 -0.9485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6164 0.9658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1691 0.6467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1691 0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6164 -0.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7216 0.9657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7989 0.2831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0844 0.9596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7989 0.5471 0.0000 C 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 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 2 8 1 0 0 0 0 10 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 10 1 0 0 0 0 16 17 1 0 0 0 0 14 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 15 1 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 5 24 1 0 0 0 0 24 25 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 24 25 M SBL 1 1 26 M SMT 1 OCH3 M SBV 1 26 -5.5316 3.1252 S SKP 8 ID FL1C1ANP0004 KNApSAcK_ID C00007063 NAME 4-Methoxylonchocarpin CAS_RN 51589-67-4 FORMULA C21H20O4 EXACTMASS 336.136159128 AVERAGEMASS 336.38109999999995 SMILES c(c3O)(ccc(c32)OC(C=C2)(C)C)C(=O)C=Cc(c1)ccc(OC)c1 M END