Mol:FL2FABNI0008
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 33 0 0 0 0 0 0 0 0999 V2000 -3.5635 -0.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 -1.7952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7678 -2.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -1.7794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0988 -0.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8245 -0.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -2.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6842 -1.8039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6935 -0.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3773 -0.5543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7121 -0.9115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4235 -0.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4439 0.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7322 0.7415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0118 0.3413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -3.0298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2780 -0.5789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7678 -3.0050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1584 0.7242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1379 -0.9255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -0.5156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5646 -0.9293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5646 -1.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -0.5175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7261 0.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7322 1.4932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 1.9318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 2.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8872 3.0298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0633 3.0104 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 14 20 1 0 0 0 0 13 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 20 26 1 0 0 0 0 15 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 FL2FABNI0008 KNApSAcK_ID C00014175 NAME Abyssinone V 4'-methyl ether;5,7-Dihydroxy-4'-methoxy-3',5'-diprenylflavanone CAS_RN 201480-12-8 FORMULA C26H30O5 EXACTMASS 422.20932407 AVERAGEMASS 422.5134 SMILES C(C2=O)C(c(c3)cc(CC=C(C)C)c(OC)c(CC=C(C)C)3)Oc(c21)cc(O)cc1O M END