Mol:FL2FA9NI0023
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 33 0 0 0 0 0 0 0 0999 V2000 -1.5338 -0.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5152 -1.1966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7381 -1.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0832 -1.1808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -0.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7947 0.0692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6717 -1.6062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3455 -1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3363 -0.3389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6524 0.0443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0508 0.0736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7419 -0.3129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4532 0.0856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4737 0.9103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7619 1.3401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0416 0.9399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6717 -2.4312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2482 0.0197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7381 -2.4064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7619 2.2234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1075 -0.2922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7947 0.9374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4748 1.3300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4748 2.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8279 2.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1777 2.4312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1671 -1.5730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8342 -1.1879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4961 -1.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4961 -2.3147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1075 -1.2170 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 6 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 1 18 1 0 0 0 0 3 19 1 0 0 0 0 15 20 1 0 0 0 0 13 21 1 0 0 0 0 6 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 2 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 S SKP 8 ID FL2FA9NI0023 KNApSAcK_ID C00014177 NAME Monotesone B;5,7,3',5'-Tetrahydroxy-6,8-diprenylflavanone CAS_RN 208596-56-9 FORMULA C25H28O6 EXACTMASS 424.188588628 AVERAGEMASS 424.48622 SMILES O=C(C2)c(c(OC2c(c3)cc(O)cc(O)3)1)c(O)c(CC=C(C)C)c(c(CC=C(C)C)1)O M END