Mol:FL2FA9NF0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 25 28 0 0 0 0 0 0 0 0999 V2000 -1.8062 -0.0585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7877 -0.8623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0105 -1.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3557 -0.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3415 -0.0215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0672 0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3993 -1.2719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0731 -0.8710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0638 -0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 0.3786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7783 0.4079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4694 0.0214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1807 0.4199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2012 1.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4895 1.6745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7691 1.2743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3992 -2.0136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2782 1.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1476 1.3098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 0.5017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0105 -2.0005 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6597 -2.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6051 1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4422 2.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2012 1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 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 6 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 1 1 0 0 0 0 3 21 1 0 0 0 0 21 22 1 0 0 0 0 19 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 S SKP 8 ID FL2FA9NF0001 KNApSAcK_ID C00014207 NAME Emoroidenone;5-Methoxy-5''-[2'',3'':7,8]-isopropenyldihydrofuranoflavanone CAS_RN 169532-89-2 FORMULA C21H20O4 EXACTMASS 336.136159128 AVERAGEMASS 336.38109999999995 SMILES O(C3c(c4)cccc4)c(c12)c(C(=O)C3)c(cc1OC(C2)C(C)=C)OC M END