HMDB0031813 RDKit 3D N-Carbamoyl-2-amino-2-(4-hydroxyphenyl)acetic acid 25 25 0 0 0 0 0 0 0 0999 V2000 -4.1405 1.0233 0.5869 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2172 0.2535 -0.1811 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6244 -0.2418 -1.2523 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 0.0605 0.2534 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8019 -0.5940 -0.3245 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7346 -2.0496 -0.3754 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9122 -2.6322 -1.5143 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -2.9136 0.6685 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5624 -0.0184 -0.1447 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5817 -0.7941 0.2708 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 -0.3560 0.2948 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 0.9554 -0.1299 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4161 1.4281 -0.1327 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0606 1.7516 -0.5382 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 1.2986 -0.5696 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9136 2.0543 0.6399 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9390 0.6659 1.0815 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6612 0.5259 1.2211 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9633 -0.3504 -1.5083 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1691 -3.8455 0.6458 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3723 -1.8071 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -0.9698 0.6718 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8126 1.8816 0.6303 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 2.7592 -0.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0536 1.9147 -0.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 5 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 2 0 15 9 1 0 1 16 1 0 1 17 1 0 4 18 1 0 5 19 1 0 8 20 1 0 10 21 1 0 11 22 1 0 13 23 1 0 14 24 1 0 15 25 1 0 M END