HMDB0029938 RDKit 3D Acaciabiuronic acid 44 45 0 0 0 0 0 0 0 0999 V2000 -5.7060 0.1877 -0.0386 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6814 0.5664 0.5569 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 1.1699 1.7867 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 0.3647 -0.0633 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3895 0.8348 0.7245 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0882 0.4906 0.4618 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5947 1.4007 -0.4332 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4471 2.1560 0.0181 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 1.4355 0.2725 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5997 0.4573 1.2035 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8315 -0.1216 1.4922 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6238 -1.0402 2.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4293 -0.8350 0.3318 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8295 -0.6534 0.4115 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9741 -0.3692 -1.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0705 -0.3711 -1.8938 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 0.9236 -1.0558 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2051 0.9127 -1.9788 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8917 -0.8962 -0.0533 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1896 -1.7961 0.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8937 -1.2060 -1.1703 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7678 -0.1542 -2.0959 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2424 -1.0719 -0.4913 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2714 -1.3662 -1.3758 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4292 2.0596 2.0511 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3698 0.9675 -1.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5488 0.5798 1.4191 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5948 2.9640 -0.7747 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1775 2.7348 0.9446 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4851 2.2140 0.6356 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5164 0.6648 1.9189 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -1.8596 2.2098 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -1.9390 0.4418 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2374 -1.3943 -0.0952 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -1.1660 -1.4294 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6295 0.4395 -1.7595 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9696 1.6964 -1.4666 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3544 0.1253 -2.5638 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1011 -1.0815 -0.4795 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5149 -1.7369 1.7157 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7151 -2.1849 -1.6076 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2365 -0.3554 -2.9373 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2691 -1.7411 0.3821 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8797 -2.0058 -0.9358 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 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 11 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 6 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 23 4 1 0 17 9 1 0 3 25 1 0 4 26 1 0 6 27 1 0 8 28 1 0 8 29 1 0 9 30 1 0 11 31 1 0 12 32 1 0 13 33 1 0 14 34 1 0 15 35 1 0 16 36 1 0 17 37 1 0 18 38 1 0 19 39 1 0 20 40 1 0 21 41 1 0 22 42 1 0 23 43 1 0 24 44 1 0 M END