HMDB0037145 RDKit 3D 3-(4-Methoxyphenyl)-2-methyl-2-propenal 25 25 0 0 0 0 0 0 0 0999 V2000 4.4958 -0.7070 -0.0061 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4789 -0.3259 0.8665 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1234 -0.3570 0.5408 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1524 0.0266 1.4287 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1838 -0.0043 1.1066 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5649 -0.4308 -0.1406 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9541 -0.4815 -0.5609 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7793 0.4928 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3984 1.7138 0.4195 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1725 0.3540 -0.7592 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5559 -0.6773 -1.3813 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4033 -0.8188 -1.0403 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7496 -0.7890 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5297 -1.8067 -0.1879 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3853 -0.2468 -1.0277 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5113 -0.4449 0.3672 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4378 0.3605 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9382 0.3052 1.8585 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3438 -1.3591 -1.1152 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7711 1.7392 1.4854 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3644 2.0337 0.2984 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0108 2.5452 -0.0595 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8983 1.1323 -0.5713 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1443 -1.1620 -2.0327 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5237 -1.0919 -1.4182 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 7 8 2 0 8 9 1 0 8 10 1 0 10 11 2 0 6 12 1 0 12 13 2 0 13 3 1 0 1 14 1 0 1 15 1 0 1 16 1 0 4 17 1 0 5 18 1 0 7 19 1 0 9 20 1 0 9 21 1 0 9 22 1 0 10 23 1 0 12 24 1 0 13 25 1 0 M END