HMDB0094723 RDKit 3D 2-hydroxyphenylpropionylglycine 29 29 0 0 0 0 0 0 0 0999 V2000 4.8066 1.5104 -0.7937 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2655 0.9631 0.1925 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 1.1467 1.4529 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0654 0.1212 -0.0479 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7337 0.0855 -1.4013 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9721 0.7207 0.6639 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8335 0.1403 0.7089 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1556 0.8104 1.4266 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6144 -1.1417 0.0413 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3837 -0.9591 -1.0758 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7011 -0.4580 -0.6201 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6882 -1.3268 -0.2005 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9203 -0.8670 0.2154 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2169 0.4799 0.2292 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2533 1.3740 -0.1838 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0285 0.8918 -0.5956 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3327 0.9050 2.3103 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3237 -0.9025 0.2693 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5105 0.2135 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0272 0.9964 2.3903 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5429 -1.5992 -0.3501 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -1.9049 0.7533 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0006 -0.2297 -1.8298 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4981 -1.9200 -1.6592 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -2.3834 -0.1885 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7041 -1.5449 0.5478 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1702 0.8596 0.5494 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4995 2.4272 -0.1679 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2783 1.5916 -0.9239 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 4 6 1 0 6 7 2 3 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 11 1 0 3 17 1 0 4 18 1 0 5 19 1 0 8 20 1 0 9 21 1 0 9 22 1 0 10 23 1 0 10 24 1 0 12 25 1 0 13 26 1 0 14 27 1 0 15 28 1 0 16 29 1 0 M END