HMDB0012883 RDKit 3D Adrenochrome o-semiquinone 23 24 0 0 0 0 0 0 0 0999 V2000 -1.8465 -2.1189 0.0913 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -0.7967 0.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9679 0.4372 0.7291 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2874 1.4392 -0.1721 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3838 2.7390 0.3009 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1063 0.9378 -0.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3492 1.4866 -0.4264 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4719 0.6917 -0.3743 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7148 1.2622 -0.6064 O 0 0 0 0 0 1 0 0 0 0 0 0 2.4142 -0.6552 -0.0998 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5944 -1.3781 -0.0676 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1793 -1.2195 0.1305 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0457 -0.4112 0.0768 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9379 -2.1421 0.1204 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3811 -2.7873 0.8643 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5411 -2.5601 -0.8863 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6372 0.6578 1.7629 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0502 0.4020 0.6046 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6872 1.3607 -1.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8353 3.3308 -0.3821 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3809 2.5471 -0.6413 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4804 -0.9451 -0.2384 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1355 -2.2778 0.3460 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 1 0 8 10 2 0 10 11 1 0 10 12 1 0 12 13 2 0 13 2 1 0 13 6 1 0 1 14 1 0 1 15 1 0 1 16 1 0 3 17 1 0 3 18 1 0 4 19 1 0 5 20 1 0 7 21 1 0 11 22 1 0 12 23 1 0 M RAD 1 9 2 M END