HMDB0303993 RDKit 3D (R+)-3-(4-hydroxyphenyl)lactate 22 22 0 0 0 0 0 0 0 0999 V2000 3.9011 -1.2407 0.0304 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1752 -0.2331 0.0767 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6973 1.0016 -0.2767 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7612 -0.2966 0.4981 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3687 -1.5930 0.8238 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8994 0.2201 -0.6375 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5442 0.1819 -0.2742 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -0.9386 -0.5404 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6566 -0.9850 -0.2073 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2826 0.0823 0.4037 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6273 0.0574 0.7467 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.5239 1.2011 0.6725 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1905 1.2370 0.3371 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1205 1.8282 -0.4146 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6437 0.3105 1.4122 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8983 -2.2571 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1176 -0.3745 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1995 1.2637 -0.8732 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8392 -1.7730 -1.0146 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2352 -1.8777 -0.4288 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9786 2.0562 1.1498 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5895 2.1292 0.5525 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 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 12 13 2 0 13 7 1 0 3 14 1 0 4 15 1 1 5 16 1 0 6 17 1 0 6 18 1 0 8 19 1 0 9 20 1 0 12 21 1 0 13 22 1 0 M CHG 1 11 -1 M END