HMDB0062182 RDKit 3D N-lactoyl-Methionine 29 28 0 0 0 0 0 0 0 0999 V2000 4.5067 1.3277 -0.7443 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7769 0.8866 -0.7934 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5052 -0.7477 -0.0424 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0517 -1.1315 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2049 -0.1272 0.5423 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2241 -0.4114 0.4349 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0568 0.5649 -0.1578 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5663 1.6717 -0.5803 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5084 0.4072 -0.3400 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8403 -0.6700 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0505 1.5962 -0.8333 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4587 -0.0992 2.0124 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5668 0.1528 2.7885 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6337 -0.3145 2.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7356 2.0368 -1.5988 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1484 0.4464 -0.8972 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7827 1.8988 0.1799 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1009 -1.4657 -0.6944 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9787 -0.7870 0.9199 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7554 -1.3702 -1.1715 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9408 -2.1020 0.4494 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 0.8804 0.1127 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6295 -1.2918 0.7776 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0104 0.1701 0.6148 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5402 -1.6394 -0.9437 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9562 -0.6421 -1.4832 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3746 -0.3958 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5671 2.3274 -0.3393 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9358 -1.1715 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 9 11 1 0 5 12 1 0 12 13 2 0 12 14 1 0 1 15 1 0 1 16 1 0 1 17 1 0 3 18 1 0 3 19 1 0 4 20 1 0 4 21 1 0 5 22 1 0 6 23 1 0 9 24 1 1 10 25 1 0 10 26 1 0 10 27 1 0 11 28 1 0 14 29 1 0 M END