HMDB0004259 RDKit 3D Acetyl-N-formyl-5-methoxykynurenamine 35 35 0 0 0 0 0 0 0 0999 V2000 3.1346 -2.4755 2.2161 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9015 -1.9647 1.7791 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8968 -0.7160 1.1564 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0491 -0.0021 0.9714 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 1.2424 0.3525 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8633 1.7883 -0.0943 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 3.0791 -0.6601 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0411 3.7632 -1.0525 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2291 3.4349 -1.0102 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6841 1.0582 0.0932 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5905 1.5190 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7454 2.5754 -1.0525 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8586 0.7732 -0.1501 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1277 -0.2399 -1.2255 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3485 -0.9702 -1.0092 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5893 -1.7582 0.1283 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8654 -2.4820 0.2874 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7199 -1.8524 1.0183 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7036 -0.1909 0.7182 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8741 -2.5691 1.3895 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -3.4498 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5361 -1.7572 2.9695 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0215 -0.3872 1.3064 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9784 1.7676 0.2388 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9518 3.5708 -0.7667 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8802 4.7844 -1.4803 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8433 0.3062 0.8148 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7358 1.4859 -0.1436 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1052 0.2561 -2.2229 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -0.9838 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0878 -0.8873 -1.7706 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 -3.5046 0.6271 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5071 -2.0265 1.0704 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4266 -2.4679 -0.6681 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2243 -0.7194 0.8389 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 2 0 6 7 1 0 7 8 1 0 8 9 2 0 6 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 2 0 10 19 2 0 19 3 1 0 1 20 1 0 1 21 1 0 1 22 1 0 4 23 1 0 5 24 1 0 7 25 1 0 8 26 1 0 13 27 1 0 13 28 1 0 14 29 1 0 14 30 1 0 15 31 1 0 17 32 1 0 17 33 1 0 17 34 1 0 19 35 1 0 M END