HMDB0004083 RDKit 3D 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid 25 25 0 0 0 0 0 0 0 0999 V2000 -1.3966 1.7121 -1.1571 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7172 0.5641 -0.4145 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0443 0.3106 -0.1015 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0429 1.1804 -0.5169 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3862 -0.8108 0.6274 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3983 -1.6771 1.0419 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0855 -1.4330 0.7363 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7416 -0.3170 0.0106 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.0691 -0.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0287 0.9369 -0.9689 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6848 -1.0175 0.1527 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0574 -0.5738 -0.2825 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2034 0.4722 -0.9418 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2266 -1.3629 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0695 -2.4119 0.7253 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4799 -0.9405 -0.3449 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5476 1.7701 -2.1782 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9949 2.5314 -0.6698 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9849 0.9715 -0.2769 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4321 -1.0277 0.8846 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6537 -2.5622 1.6155 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2745 -2.1081 1.0545 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5356 -2.0193 -0.2963 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6699 -1.0980 1.2561 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0716 -0.4166 0.2909 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 3 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 2 0 14 16 1 0 8 2 1 0 1 17 1 0 1 18 1 0 4 19 1 0 5 20 1 0 6 21 1 0 7 22 1 0 11 23 1 0 11 24 1 0 16 25 1 0 M END