HMDB0245773 RDKit 3D 3-(2-Hydroxyethyl)histidine 27 27 0 0 0 0 0 0 0 0999 V2000 2.2036 -1.0877 0.9810 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6636 0.1866 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9125 -0.0479 -0.8162 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2262 -0.9605 -0.7506 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0768 -2.3490 -0.8763 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3105 -2.8561 -0.8310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1971 -1.8637 -0.6858 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5332 -0.6767 -0.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1867 0.5893 -0.4696 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4979 0.9432 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4215 1.0316 1.7996 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8719 0.9859 0.0463 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9954 0.4671 0.1967 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 2.2416 -0.4852 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6984 -1.5111 0.1638 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -0.7950 1.6452 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1265 0.7230 1.2441 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5614 0.9783 -1.1399 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6581 -0.3267 -1.5936 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8615 -2.8723 -0.9861 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2845 -1.9289 -0.6143 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5829 1.4066 -0.9613 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1621 0.6334 -1.0369 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0621 1.9037 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2531 0.1835 1.3252 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0999 1.9839 1.8528 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6244 3.0179 0.1854 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 2 12 1 0 12 13 2 0 12 14 1 0 8 4 1 0 1 15 1 0 1 16 1 0 2 17 1 0 3 18 1 0 3 19 1 0 5 20 1 0 7 21 1 0 9 22 1 0 9 23 1 0 10 24 1 0 10 25 1 0 11 26 1 0 14 27 1 0 M END