HMDB0031412 RDKit 3D 2-Amino-4-[(2-hydroxy-1-oxopropyl)amino]butanoic acid 27 26 0 0 0 0 0 0 0 0999 V2000 -4.2098 -0.8332 0.0381 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2096 0.2411 0.3934 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5216 1.3760 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8139 -0.2180 0.1295 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4525 -1.2501 0.7463 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9467 0.4592 -0.7563 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4066 0.0161 -1.0112 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2394 0.0104 0.2449 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -0.4526 0.0470 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3724 -0.4246 1.3397 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4461 0.3427 -0.8993 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 0.4014 -2.1015 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5609 1.0300 -0.4609 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0451 -1.6859 0.7544 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2162 -0.3945 0.1698 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1354 -1.1605 -1.0188 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2881 0.4013 1.4894 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8141 2.0667 0.3171 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3058 1.3076 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3435 -1.0218 -1.4531 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8748 0.6202 -1.8311 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7748 -0.6804 0.9832 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2121 1.0352 0.6917 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -1.5256 -0.2469 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3791 -0.3405 1.1293 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2436 -1.3520 1.8376 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6728 2.0318 -0.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 2 0 11 13 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 3 18 1 0 6 19 1 0 7 20 1 0 7 21 1 0 8 22 1 0 8 23 1 0 9 24 1 6 10 25 1 0 10 26 1 0 13 27 1 0 M END