HMDB0249591 RDKit 3D Canrenoic acid 56 59 0 0 0 0 0 0 0 0999 V2000 -2.9384 -1.9424 -0.6086 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8086 -0.4804 -0.1671 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7687 0.2802 -1.0666 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1536 -0.3096 -1.0123 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5113 -0.7951 0.3365 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5451 -1.4474 0.5184 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5945 -0.4672 1.4161 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2989 -0.3084 1.2143 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3599 0.0306 2.2707 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2174 0.6850 1.9818 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9645 1.0349 0.5761 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3884 -0.0151 -0.3931 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4172 -1.1345 -0.5718 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -0.9821 -0.1199 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4322 0.2662 0.5078 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8169 0.0404 1.9774 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4427 1.4119 0.3752 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7519 2.0162 -0.9704 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0325 1.3206 -1.4669 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6044 0.9380 -0.1345 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6986 2.1862 0.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9184 0.3625 -0.0897 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2128 -0.9692 -0.6545 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6897 -1.2214 -0.4239 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2055 -2.3099 -0.8205 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5071 -0.3169 0.2018 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9718 -2.1788 -0.9561 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3003 -2.1816 -1.4784 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7591 -2.6224 0.2535 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4494 0.2694 -2.1278 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7507 1.3398 -0.7362 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3685 -1.0153 -1.8292 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8437 0.5736 -1.1865 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9442 -0.3395 2.4509 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5837 -0.2406 3.2714 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5042 0.9573 2.7232 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5818 1.9455 0.3629 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4459 0.5372 -1.3873 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4571 -1.4436 -1.6646 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8531 -2.0312 -0.0511 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2904 -1.8341 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6333 -1.1619 -1.0196 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1323 -0.7403 2.3828 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8308 -0.4440 2.0343 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8813 0.9566 2.5521 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 2.1242 1.2114 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0493 1.9817 -1.6956 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0674 3.0753 -0.7926 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6728 2.0507 -2.0121 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8254 0.5069 -2.1549 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2916 2.7501 -0.0243 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6114 1.0805 -0.6343 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3242 0.3877 0.9529 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1109 -1.0286 -1.7572 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7385 -1.8200 -0.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4224 0.6721 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 2 0 8 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 1 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 8 2 1 0 17 11 1 0 12 2 1 0 20 15 1 0 1 27 1 0 1 28 1 0 1 29 1 0 3 30 1 0 3 31 1 0 4 32 1 0 4 33 1 0 7 34 1 0 9 35 1 0 10 36 1 0 11 37 1 0 12 38 1 0 13 39 1 0 13 40 1 0 14 41 1 0 14 42 1 0 16 43 1 0 16 44 1 0 16 45 1 0 17 46 1 0 18 47 1 0 18 48 1 0 19 49 1 0 19 50 1 0 21 51 1 0 22 52 1 0 22 53 1 0 23 54 1 0 23 55 1 0 26 56 1 0 M END