HMDB0000625 RDKit 3D Gluconic acid 25 24 0 0 0 0 0 0 0 0999 V2000 3.6956 -0.0617 1.4192 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5956 -0.4739 0.9694 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7514 -1.1292 1.8494 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1738 -0.2922 -0.4342 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2409 0.3674 -1.0906 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 0.5609 -0.5741 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7175 0.6694 -1.9739 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2928 -0.1346 0.0078 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4042 -1.4053 -0.5694 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5558 0.6361 -0.3337 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4740 1.8921 0.2223 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7755 -0.0604 0.1943 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 -0.2007 1.5752 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5806 -0.7331 2.7776 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0014 -1.2224 -0.9792 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9173 1.1407 -1.6089 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 1.5784 -0.1843 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7787 -0.2843 -2.2971 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2472 -0.2529 1.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8161 -1.3337 -1.4459 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5977 0.7092 -1.4268 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3097 1.8432 1.1927 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8617 -1.0869 -0.2573 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 0.5266 -0.0607 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6742 -0.1997 1.9317 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 8 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 3 14 1 0 4 15 1 6 5 16 1 0 6 17 1 1 7 18 1 0 8 19 1 1 9 20 1 0 10 21 1 6 11 22 1 0 12 23 1 0 12 24 1 0 13 25 1 0 M END