HMDB0062497 RDKit 3D N-Acetyl-5-methoxykynuramine 33 33 0 0 0 0 0 0 0 0999 V2000 5.4911 -0.9660 0.1059 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1745 -1.0195 -0.4115 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1629 -0.1912 0.0953 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4066 0.7064 1.1139 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3966 1.5180 1.6039 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1207 1.4660 1.1028 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0936 2.3109 1.6214 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8591 0.5744 0.0842 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4744 0.4965 -0.4639 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3686 1.2387 -0.0055 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7691 -0.4538 -1.5553 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2126 -0.3904 -1.9952 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1187 -0.7030 -0.9176 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5306 -0.7119 -1.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4382 -1.0381 0.0544 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9889 -0.4289 -2.2246 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8839 -0.2461 -0.4098 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3802 -1.0127 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9869 0.0131 -0.0957 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1083 -1.8041 -0.2131 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4169 0.7591 1.5223 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6189 2.2133 2.4047 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 2.1821 2.5889 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3328 3.0552 1.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0802 -0.3645 -2.4181 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6159 -1.5073 -1.1766 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4882 0.6053 -2.3947 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3316 -1.1121 -2.8329 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6912 -0.9317 0.0189 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5227 -2.1393 0.2083 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4422 -0.6099 -0.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1307 -0.5730 0.9946 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6752 -0.9355 -1.1996 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 2 0 8 17 2 0 17 3 1 0 1 18 1 0 1 19 1 0 1 20 1 0 4 21 1 0 5 22 1 0 7 23 1 0 7 24 1 0 11 25 1 0 11 26 1 0 12 27 1 0 12 28 1 0 13 29 1 0 15 30 1 0 15 31 1 0 15 32 1 0 17 33 1 0 M END