HMDB0126445 RDKit 3D 6-(2-carboxy-5-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid 37 38 0 0 0 0 0 0 0 0999 V2000 0.6558 -2.6922 -0.0029 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9017 -2.6107 -0.1153 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6344 -3.7853 -0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5845 -1.3234 -0.2332 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9658 -1.2806 -0.3556 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6564 -0.0958 -0.4695 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8951 1.0543 -0.4552 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5249 2.2924 -0.5662 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5214 1.0470 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8377 -0.1360 -0.2218 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4928 -0.2899 -0.0975 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 0.7065 -0.0558 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1093 0.6200 1.1511 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3337 1.1415 1.3313 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0049 0.4685 2.4587 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1567 0.7935 2.8055 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3585 -0.5322 3.1419 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2246 1.1805 0.1204 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5625 1.0494 0.4543 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7953 0.1249 -0.9017 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7937 -1.1414 -0.3522 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3713 0.5146 -1.2579 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8929 -0.5012 -2.1098 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1303 -4.0761 0.7272 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5435 -2.2033 -0.3642 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7298 -0.0441 -0.5655 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 2.8084 0.2427 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9496 1.9720 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 1.7065 -0.1417 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2033 2.2157 1.6646 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -1.4493 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0935 2.1536 -0.3969 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0950 0.7353 -0.3246 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4467 0.2372 -1.7709 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2228 -1.8288 -0.9154 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4485 1.4392 -1.8645 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0027 -0.2704 -2.4672 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 14 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 10 4 1 0 22 12 1 0 3 24 1 0 5 25 1 0 6 26 1 0 8 27 1 0 9 28 1 0 12 29 1 0 14 30 1 0 17 31 1 0 18 32 1 0 19 33 1 0 20 34 1 0 21 35 1 0 22 36 1 0 23 37 1 0 M END