HMDB0062811 RDKit 3D D-synephrine 25 25 0 0 0 0 0 0 0 0999 V2000 2.9447 -0.8203 -0.6389 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1897 -1.0047 0.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8044 0.1714 1.2468 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8194 1.0383 0.5790 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5195 2.1734 1.3449 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4349 0.4271 0.1243 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 1.2866 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5948 0.8444 -0.8884 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9420 -0.4861 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -0.9772 -1.2769 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0122 -1.3421 -0.2781 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7727 -0.8958 0.1916 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7181 -0.0537 -0.5558 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3414 -0.6034 -1.5425 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4606 -1.7991 -0.8683 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3933 -1.8359 1.0987 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7433 0.7920 1.3731 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5398 -0.1283 2.2849 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3184 1.4410 -0.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3282 2.9171 0.7227 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1877 2.3595 -0.5192 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3389 1.5243 -1.3245 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9879 -1.0547 -0.7044 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2357 -2.3959 -0.2047 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0789 -1.5778 0.6091 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 1 0 4 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 9 11 1 0 11 12 2 0 12 6 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 4 19 1 6 5 20 1 0 7 21 1 0 8 22 1 0 10 23 1 0 11 24 1 0 12 25 1 0 M END