HMDB0029199 RDKit 3D Fertaric acid 37 37 0 0 0 0 0 0 0 0999 V2000 5.2304 1.0614 1.5632 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4084 -0.1031 0.7854 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3732 -0.7274 0.1218 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0607 -0.2516 0.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0267 -0.8630 -0.4851 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6511 -0.4042 -0.4633 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3182 0.6659 0.2146 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0534 1.1283 0.2397 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3521 2.1425 0.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0171 0.4401 -0.4532 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3699 0.9508 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7509 1.2074 -1.7842 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9497 0.9069 -2.7139 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9528 1.7731 -2.2069 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2536 -0.1253 0.2189 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7454 -0.4677 1.5003 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5973 0.4311 0.4688 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4245 0.7784 -0.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0442 0.6105 1.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3709 -2.0096 -1.2142 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6376 -2.5164 -1.2934 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6421 -1.8542 -0.6098 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9318 -2.3602 -0.6834 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7749 0.8460 2.5536 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2394 1.5133 1.7015 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6069 1.7548 0.9533 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8993 0.6385 0.7583 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1482 -0.9047 -0.9887 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0383 1.2502 0.7815 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4051 1.8400 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 2.5707 -2.8077 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2695 -1.0544 -0.3588 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1649 -1.2891 1.8225 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4538 1.5022 2.0428 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5691 -2.5026 -1.7349 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9178 -3.3966 -1.8496 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1716 -3.1820 -1.2075 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 11 15 1 0 15 16 1 0 15 17 1 0 17 18 2 0 17 19 1 0 5 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 22 3 1 0 1 24 1 0 1 25 1 0 1 26 1 0 4 27 1 0 6 28 1 0 7 29 1 0 11 30 1 0 14 31 1 0 15 32 1 0 16 33 1 0 19 34 1 0 20 35 1 0 21 36 1 0 23 37 1 0 M END