Mol:FL4D1ANI0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 35 37 0 0 0 0 0 0 0 0999 V2000 -2.6419 -1.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -1.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6001 -1.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6001 -0.8087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -0.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6419 -0.8087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0792 -1.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5583 -1.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5583 -0.8087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0792 -0.5080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0792 -2.2348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4964 -0.8168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0307 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0307 0.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4964 0.4173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 0.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1623 -0.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -1.7106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 0.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6414 0.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6414 0.9942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1617 1.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 1.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5642 0.4168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5642 -0.8163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0977 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -0.8156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1623 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -1.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4964 0.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0115 1.2684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0115 1.9484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5075 2.2348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4373 2.2075 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 6 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 6 18 1 0 0 0 0 8 19 1 1 0 0 0 5 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 15 25 1 0 0 0 0 14 26 1 0 0 0 0 26 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 32 33 2 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 S SKP 8 ID FL4D1ANI0002 KNApSAcK_ID C00008612 NAME 3,7,4'-Trihydroxy-8,3',5'-triprenylflavanone CAS_RN 90686-14-9 FORMULA C30H36O5 EXACTMASS 476.256274262 AVERAGEMASS 476.60384000000005 SMILES c(c3)c(O)c(c(c31)OC(c(c2)cc(CC=C(C)C)c(O)c2CC=C(C)C)C(O)C1=O)CC=C(C)C M END