HMDB0254880 RDKit 3D 3[N-Morpholino]propane sulfonic acid 28 28 0 0 0 0 0 0 0 0999 V2000 3.6174 2.0466 0.4634 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 1.0248 -0.4014 S 0 0 0 0 0 6 0 0 0 0 0 0 1.9885 1.5875 -1.3691 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2303 0.3577 -1.3556 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2451 -0.2991 0.4735 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1208 0.1070 1.3743 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0137 0.7620 0.6882 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 0.0204 -0.3114 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7608 0.6930 -0.9384 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0303 0.4401 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2941 -0.9169 -0.1583 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3084 -1.6511 0.4708 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9193 -1.3453 -0.0925 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9999 0.1291 -0.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0376 -0.7988 1.0748 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9326 -1.0663 -0.2822 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8499 -0.7656 1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5619 0.8491 2.1033 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7723 1.0464 1.4706 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3111 1.7271 0.2477 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5552 1.7885 -0.9088 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8176 0.4086 -1.9949 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9349 0.8871 0.8219 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8606 0.9383 -0.7154 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4951 -2.7322 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3537 -1.5130 1.5515 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8998 -1.8653 -1.0961 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1872 -1.8595 0.5267 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 2 0 2 4 1 0 2 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 8 1 0 4 14 1 0 5 15 1 0 5 16 1 0 6 17 1 0 6 18 1 0 7 19 1 0 7 20 1 0 9 21 1 0 9 22 1 0 10 23 1 0 10 24 1 0 12 25 1 0 12 26 1 0 13 27 1 0 13 28 1 0 M END