Mol:FL2FADNP0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 32 35 0 0 0 0 0 0 0 0999 V2000 -1.3065 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7857 -1.2023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2648 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2648 -0.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7857 0.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3065 -0.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2561 -1.2023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -0.3001 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2561 0.0006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2974 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2561 -1.7262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8317 -0.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3661 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3661 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8317 0.9258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2974 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7857 -1.8032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3661 0.6173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8269 0.0003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7857 0.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8269 -1.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3473 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3473 -0.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6833 0.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8996 -0.4487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 0.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 1.5028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8264 1.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7857 1.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0985 1.4923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5246 2.3970 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 3 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 4 1 0 0 0 0 9 11 1 0 0 0 0 7 12 2 0 0 0 0 11 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 11 1 0 0 0 0 2 18 1 0 0 0 0 15 19 1 0 0 0 0 6 20 1 0 0 0 0 5 21 1 0 0 0 0 1 22 1 0 0 0 0 22 23 2 0 0 0 0 20 24 1 0 0 0 0 24 23 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 21 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 16 31 1 0 0 0 0 31 32 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 31 32 M SBL 1 1 34 M SMT 1 OCH3 M SVB 1 34 2.0985 1.4923 S SKP 8 ID FL2FADNP0002 KNApSAcK_ID C00008514 NAME 3'-Methoxylupinifolin CAS_RN 144049-80-9 FORMULA C26H28O6 EXACTMASS 436.188588628 AVERAGEMASS 436.49692 SMILES O(c(c4O)cc(cc4)C(O3)CC(=O)c(c31)c(c(C=2)c(OC(C2)(C)C)c1CC=C(C)C)O)C M END