HMDB0244456 RDKit 3D N-(4-Amino-2,5-diethoxyphenyl)benzamide 42 43 0 0 0 0 0 0 0 0999 V2000 -4.9218 -2.9995 0.0802 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5486 -2.3520 -0.0465 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6918 -0.9930 0.2264 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6833 -0.0660 0.2155 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4031 -0.4726 -0.0865 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3327 0.4289 -0.1131 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -0.0259 -0.4291 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4839 -1.0640 0.1272 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7227 -1.7526 1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8246 -1.4798 -0.2354 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 -2.5771 0.3065 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7328 -2.9285 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4192 -2.1982 -1.0051 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8063 -1.0862 -1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5263 -0.7523 -1.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5671 1.7606 0.1711 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5119 2.6187 0.1351 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4654 3.9892 0.3928 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8695 4.5533 0.2454 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8553 2.1488 0.4712 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9152 1.2611 0.4984 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2316 1.7412 0.8202 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7201 -2.3187 -0.2804 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1604 -3.2082 1.1466 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9519 -3.9792 -0.4397 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8839 -2.8593 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0848 -2.5645 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1583 -1.5084 -0.3187 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2087 -1.2390 1.7621 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9262 -3.1678 1.0411 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2277 -3.7991 0.3536 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4220 -2.4519 -1.3214 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2993 -0.4881 -2.2896 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0751 0.1312 -1.6324 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 4.1211 1.4573 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2664 4.5362 -0.2298 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4652 3.9314 -0.4623 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3928 4.4738 1.2231 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8423 5.6081 -0.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0186 3.1916 0.6901 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 1.8634 1.8255 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9462 1.9733 0.1133 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 2 3 8 9 1 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 6 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 16 20 1 0 20 21 2 0 21 22 1 0 21 4 1 0 15 10 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 5 28 1 0 9 29 1 0 11 30 1 0 12 31 1 0 13 32 1 0 14 33 1 0 15 34 1 0 18 35 1 0 18 36 1 0 19 37 1 0 19 38 1 0 19 39 1 0 20 40 1 0 22 41 1 0 22 42 1 0 M END