HMDB0005802 RDKit 3D Isoeugenol 24 24 0 0 0 0 0 0 0 0999 V2000 -4.0998 -0.7656 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9305 -0.1940 0.1392 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6988 -0.4208 0.5179 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5008 0.0856 -0.1515 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5217 0.8724 -1.2756 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6204 1.3373 -1.8883 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8649 1.0225 -1.3833 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0415 1.4654 -1.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9129 0.2313 -0.2517 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1579 -0.0928 0.2665 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3234 -0.8951 1.4186 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7611 -0.2272 0.3513 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1819 -1.8180 0.5687 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9271 -0.7233 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0268 -0.2522 0.5776 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0949 0.4151 -0.7376 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5768 -1.0432 1.4118 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4731 1.1394 -1.6994 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5962 1.9620 -2.7811 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9601 2.0410 -2.7883 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5998 -1.7604 1.3624 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3522 -1.2631 1.5234 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0578 -0.2722 2.3012 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7841 -0.8439 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 9 12 2 0 12 4 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 3 17 1 0 5 18 1 0 6 19 1 0 8 20 1 0 11 21 1 0 11 22 1 0 11 23 1 0 12 24 1 0 M END