HMDB0038338 RDKit 3D alpha-Hydroxy-1-methyl-1H-indole-3-propanoic acid 29 30 0 0 0 0 0 0 0 0999 V2000 -2.1139 2.6757 0.1171 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3026 1.4988 -0.1341 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0304 1.5386 -0.5671 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3874 0.2238 -0.6794 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7214 -0.2282 -1.1187 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5348 -0.6572 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8001 -1.0878 -0.3446 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6864 0.4661 1.0563 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6922 0.9782 1.6056 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9539 0.9463 1.3328 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6484 -0.6003 -0.3092 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8136 -1.9886 -0.2251 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9888 -2.5704 0.1837 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0356 -1.7420 0.5212 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8948 -0.3568 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7047 0.2219 0.0314 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9631 2.7410 -0.6013 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5432 2.6673 1.1427 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5313 3.5916 0.0069 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5469 2.4440 -0.7831 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2954 0.5721 -1.6467 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6536 -1.1348 -1.7639 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0508 -1.4902 0.6101 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6372 -1.9202 -0.8567 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4776 1.3235 0.5309 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0069 -2.6322 -0.4841 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1448 -3.6368 0.2575 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9892 -2.1231 0.8516 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7264 0.2797 0.7152 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 2 0 8 10 1 0 4 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 2 1 0 16 11 1 0 1 17 1 0 1 18 1 0 1 19 1 0 3 20 1 0 5 21 1 0 5 22 1 0 6 23 1 0 7 24 1 0 10 25 1 0 12 26 1 0 13 27 1 0 14 28 1 0 15 29 1 0 M END