HMDB0030552 RDKit 3D Thelephoric acid 34 38 0 0 0 0 0 0 0 0999 V2000 0.9988 -0.8351 -2.3539 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4974 -0.4295 -1.2608 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9503 -0.3388 -1.1029 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9648 -0.5991 -1.8909 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1063 -0.3566 -1.2919 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4145 -0.4770 -1.7108 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4384 -0.1363 -0.8317 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7416 -0.2707 -1.2888 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1668 0.3160 0.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2224 0.6539 1.3103 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8483 0.4258 0.8311 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8031 0.0957 -0.0173 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4282 0.1096 0.1104 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5563 0.4872 1.2146 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0152 0.8938 2.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9007 0.3980 1.0613 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9119 0.6647 1.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 0.4162 1.2514 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3707 0.5247 1.6377 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4068 0.1831 0.7568 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 0.2989 1.1636 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0663 -0.2622 -0.5009 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0265 -0.6155 -1.4189 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7305 -0.3794 -0.9125 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7671 -0.0351 -0.0196 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3734 -0.0507 -0.1531 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6406 -0.8309 -2.7073 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5440 -0.0476 -0.7216 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0373 0.9869 2.2464 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5867 0.7752 1.8177 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 0.8776 2.6347 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5255 0.0794 0.6063 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0008 -0.5572 -1.1943 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4634 -0.7241 -1.8863 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 2 0 6 7 1 0 7 8 1 0 7 9 2 0 9 10 1 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 20 22 2 0 22 23 1 0 22 24 1 0 24 25 2 0 25 26 1 0 26 2 1 0 13 3 2 0 26 16 2 0 12 5 1 0 25 18 1 0 6 27 1 0 8 28 1 0 10 29 1 0 11 30 1 0 19 31 1 0 21 32 1 0 23 33 1 0 24 34 1 0 M END