HMDB0253945 RDKit 3D Lactobionic acid 46 46 0 0 0 0 0 0 0 0999 V2000 2.9223 1.6525 -3.9598 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2279 1.6178 -2.7476 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7254 2.7212 -2.1156 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0642 0.3565 -1.9172 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5484 -0.6236 -2.7628 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0669 0.7248 -0.8594 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6006 1.6786 0.0099 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4385 -0.4525 -0.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4525 0.0703 0.6223 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -0.1873 0.3624 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3915 1.0337 -0.0828 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 0.7725 -0.3775 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 1.7637 -1.4316 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4769 1.6151 -1.8183 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5081 0.9057 0.8965 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6848 0.1478 0.8798 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5945 0.4592 2.0416 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4194 -0.0956 3.0074 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6772 -0.6340 1.5217 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5533 -1.6839 1.1733 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4991 -1.2315 0.5028 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3761 -1.7086 -0.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0621 -2.4073 1.3268 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1983 -2.9784 1.9121 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2172 3.5556 -1.8879 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0664 0.1317 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2208 -0.9172 -3.4121 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2535 1.2831 -1.4106 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5465 1.4711 0.2361 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9693 -1.0728 -0.9327 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0076 -0.8633 -0.5274 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7748 -0.2577 -0.7918 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9237 2.7827 -1.1054 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5224 1.5628 -2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6269 0.6235 -1.9313 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8127 1.9627 1.0268 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0085 -0.0010 1.8084 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0433 1.3435 2.3933 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8325 -0.4228 3.7434 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0783 -0.9615 2.3954 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8013 -2.2320 1.9406 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1218 -0.5551 1.1532 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7849 -2.5915 -0.2017 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4701 -2.0065 2.1807 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5607 -3.1876 0.7653 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0801 -3.1644 2.8638 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 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 12 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 8 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 19 10 1 0 3 25 1 0 4 26 1 0 5 27 1 0 6 28 1 0 7 29 1 0 8 30 1 0 10 31 1 0 12 32 1 0 13 33 1 0 13 34 1 0 14 35 1 0 15 36 1 0 16 37 1 0 17 38 1 0 18 39 1 0 19 40 1 0 20 41 1 0 21 42 1 0 22 43 1 0 23 44 1 0 23 45 1 0 24 46 1 0 M END