HMDB0033111 RDKit 3D Epijasminoside A 49 50 0 0 0 0 0 0 0 0999 V2000 -2.9281 -2.6375 -0.1342 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2949 -1.2589 0.2698 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5618 -0.9270 0.4287 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8761 0.4380 0.8262 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8915 0.6932 1.5069 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9857 1.5242 0.4194 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6323 1.1133 -0.0405 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6279 2.1212 0.5302 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5331 1.1980 -1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2599 -0.2347 0.5018 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9419 -0.7274 0.0134 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0859 0.1967 0.2032 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3055 -0.2914 -0.2627 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1318 -0.4415 0.8419 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4233 -0.8167 0.4947 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1891 -1.0861 1.7677 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2402 0.0475 2.5775 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0673 0.3430 -0.2038 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3541 -0.0624 -0.6027 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3022 0.6816 -1.4381 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7562 -0.1162 -2.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8213 0.6621 -1.2843 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2759 0.2783 -2.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5487 -3.1524 0.7766 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8285 -3.2000 -0.4588 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2047 -2.6638 -0.9729 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3778 -1.6467 0.2708 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9297 2.2483 1.2844 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5172 2.1162 -0.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1579 3.0886 0.6806 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 2.3179 -0.1848 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2657 1.7939 1.5303 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5351 0.1891 -2.0192 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3926 1.7494 -1.9794 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6193 1.7546 -1.8689 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -0.1146 1.6194 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -1.0462 -1.0477 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6672 -1.6266 0.6041 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1586 -1.3281 -0.6844 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4571 -1.7317 -0.1187 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7292 -1.9437 2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 -1.3844 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1692 0.3283 2.7673 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1071 1.2035 0.4919 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7622 0.6625 -1.1243 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5899 1.7367 -1.7215 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4878 -1.0476 -2.4269 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4039 1.6928 -1.1046 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4669 -0.6933 -2.6844 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 7 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 15 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 10 2 1 0 22 13 1 0 1 24 1 0 1 25 1 0 1 26 1 0 3 27 1 0 6 28 1 0 6 29 1 0 8 30 1 0 8 31 1 0 8 32 1 0 9 33 1 0 9 34 1 0 9 35 1 0 10 36 1 0 11 37 1 0 11 38 1 0 13 39 1 0 15 40 1 0 16 41 1 0 16 42 1 0 17 43 1 0 18 44 1 0 19 45 1 0 20 46 1 0 21 47 1 0 22 48 1 0 23 49 1 0 M END