HMDB0000150 RDKit 3D Gluconolactone 22 22 0 0 0 0 0 0 0 0999 V2000 -1.4684 -1.1685 -2.5741 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9029 -0.9008 -1.4591 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4729 -0.8258 -1.3078 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9838 0.2110 -0.5060 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4694 0.0811 -0.2837 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8288 -1.0870 0.3392 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2865 0.3220 0.8353 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6365 1.5906 1.3453 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2122 0.3339 0.6916 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7539 0.0615 1.9503 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7389 -0.6596 -0.2761 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9959 -0.2258 -0.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8327 1.2082 -1.0065 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8513 0.9383 0.2726 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9637 0.1014 -1.2955 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7249 -1.3630 0.0112 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -0.4255 1.5617 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 2.2201 0.5717 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5247 1.3556 0.3508 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 0.8449 2.3527 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -1.6471 0.2178 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5347 -0.9652 -1.0835 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 4 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 11 2 1 0 4 13 1 6 5 14 1 0 5 15 1 0 6 16 1 0 7 17 1 1 8 18 1 0 9 19 1 6 10 20 1 0 11 21 1 1 12 22 1 0 M END