HMDB0000671 RDKit 3D Indolelactic acid 26 27 0 0 0 0 0 0 0 0999 V2000 3.6213 0.9879 -0.0367 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5296 0.4782 -0.4519 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6306 1.3942 -0.9679 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3447 -0.9548 -0.3507 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5743 -1.5172 0.0651 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2437 -1.4943 0.4749 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0979 -1.0457 0.0648 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -1.7458 -0.8432 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0279 -1.0702 -1.0482 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 0.0428 -0.3124 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9389 1.0553 -0.1776 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6486 2.0872 0.6732 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4679 2.1395 1.3812 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5539 1.1257 1.2275 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8229 0.0803 0.3787 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4886 2.3298 -0.6128 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2286 -1.3495 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6323 -2.4401 -0.2265 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2615 -2.6224 0.3447 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4045 -1.3726 1.5726 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6443 -2.6901 -1.3053 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7975 -1.3814 -1.6877 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8639 1.0014 -0.7401 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 2.8743 0.7952 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2297 2.9514 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3809 1.1361 1.7661 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 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 7 1 0 15 10 1 0 3 16 1 0 4 17 1 6 5 18 1 0 6 19 1 0 6 20 1 0 8 21 1 0 9 22 1 0 11 23 1 0 12 24 1 0 13 25 1 0 14 26 1 0 M END