HMDB0030905 RDKit 3D 1-(4-Methoxyphenyl)-1-penten-3-one 28 28 0 0 0 0 0 0 0 0999 V2000 -5.5900 0.4051 -0.3497 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3608 -0.4218 -0.0688 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1636 0.4152 -0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3115 1.5817 -0.7542 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8148 -0.1480 -0.1651 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 0.6219 -0.4291 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5966 0.1929 -0.2842 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6226 1.0816 -0.5888 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9421 0.7018 -0.4606 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3049 -0.5579 -0.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6281 -0.9592 0.1048 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7235 -0.1434 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2749 -1.4240 0.2662 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9353 -1.0625 0.1442 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4052 0.9368 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7259 1.1501 0.4552 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5096 -0.2079 -0.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -0.7327 1.0137 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3361 -1.3257 -0.7151 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6837 -1.1618 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9811 1.6406 -0.7768 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3536 2.0826 -0.9303 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7243 1.4077 -0.7025 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6295 -0.5934 0.3269 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5505 0.8795 0.2221 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9526 -0.1336 -1.2721 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5196 -2.4222 0.6068 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2094 -1.8033 0.3980 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 3 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 10 13 1 0 13 14 2 0 14 7 1 0 1 15 1 0 1 16 1 0 1 17 1 0 2 18 1 0 2 19 1 0 5 20 1 0 6 21 1 0 8 22 1 0 9 23 1 0 12 24 1 0 12 25 1 0 12 26 1 0 13 27 1 0 14 28 1 0 M END