HMDB0304192 RDKit 3D 4alpha-carboxy-5alpha-cholesta-8,24-dien-3beta-ol 74 77 0 0 0 0 0 0 0 0999 V2000 7.5569 -1.3859 -1.3653 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7856 -0.4732 -0.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0582 -0.6425 1.0059 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9376 0.4189 -0.9143 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1345 1.3537 -0.1262 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6533 1.2529 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0432 -0.0906 -0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1964 -0.4202 1.3487 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7898 -0.3647 -0.7778 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -1.7720 -0.3669 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2924 -1.5759 0.7163 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0448 -0.1066 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4968 0.0514 0.7389 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2385 0.2530 -0.3404 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6787 -0.2771 -1.6154 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2942 0.1716 -1.8701 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5649 0.4087 -0.6306 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6759 1.9038 -0.4999 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5095 0.9622 -0.2089 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1601 2.4575 -0.1089 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3844 0.8521 -1.4358 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8731 -0.5539 -1.5386 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9007 -0.7496 -0.4427 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0112 -2.0902 -0.0782 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6907 0.1533 0.7303 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2503 -0.4517 1.9689 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5838 -1.6450 2.0823 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4224 0.3583 3.0960 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.2466 0.4932 0.9942 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5430 -0.5923 1.7805 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1447 -0.0210 2.0791 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5218 -1.6508 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7507 -0.7857 -2.2776 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9681 -2.3026 -1.5913 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0878 -1.0937 1.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0082 0.3223 1.5493 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3828 -1.4177 1.4702 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8410 0.4441 -2.0212 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3395 1.2474 0.9498 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4173 2.4235 -0.3639 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5323 1.4255 -1.4944 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1973 2.0666 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7955 -0.8178 -0.5788 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2735 -0.3220 1.5926 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9631 -1.4754 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7006 0.2974 2.0323 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0194 -0.4721 -1.8851 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8213 -2.2517 -1.2433 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1709 -2.3656 -0.0397 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6174 -1.9044 1.7149 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6376 -2.1811 0.5049 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3915 0.4880 1.4787 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3194 0.0035 -2.4757 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6784 -1.4072 -1.6123 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1865 -0.5832 -2.5625 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3501 1.0957 -2.5188 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3264 2.3823 -0.7454 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8472 2.2432 0.5443 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3463 2.3701 -1.2469 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3115 2.5512 0.5936 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9805 2.8514 -1.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0574 2.9283 0.3856 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9216 1.2589 -2.3324 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2875 1.4952 -1.2232 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0676 -1.3163 -1.4852 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3668 -0.7321 -2.5328 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8839 -0.4748 -0.8942 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6722 -2.5697 -0.6397 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2293 1.1300 0.5916 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2907 1.3667 1.7158 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3922 -1.5100 1.1905 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 -0.7699 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6396 -0.8116 2.6832 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2053 0.9459 2.5796 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 14 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 25 29 1 0 29 30 1 0 30 31 1 0 17 9 1 0 29 19 1 0 17 12 1 0 31 13 1 0 1 32 1 0 1 33 1 0 1 34 1 0 3 35 1 0 3 36 1 0 3 37 1 0 4 38 1 0 5 39 1 0 5 40 1 0 6 41 1 0 6 42 1 0 7 43 1 0 8 44 1 0 8 45 1 0 8 46 1 0 9 47 1 0 10 48 1 0 10 49 1 0 11 50 1 0 11 51 1 0 12 52 1 0 15 53 1 0 15 54 1 0 16 55 1 0 16 56 1 0 18 57 1 0 18 58 1 0 18 59 1 0 20 60 1 0 20 61 1 0 20 62 1 0 21 63 1 0 21 64 1 0 22 65 1 0 22 66 1 0 23 67 1 0 24 68 1 0 25 69 1 0 29 70 1 0 30 71 1 0 30 72 1 0 31 73 1 0 31 74 1 0 M CHG 1 28 -1 M END