HMDB0036653 RDKit 3D Micromeric acid 79 83 0 0 0 0 0 0 0 0999 V2000 6.2207 -1.9271 1.0968 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2346 -1.0798 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5318 0.3752 1.1381 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2488 1.1786 0.8615 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7785 0.7047 -0.4967 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0473 0.5636 -1.2913 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3412 -0.5230 -1.7635 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8288 1.6587 -1.4577 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9246 1.6786 -1.2174 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4988 1.3372 -1.4201 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8972 0.7108 -0.1888 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9031 1.7194 0.9095 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7017 -0.5024 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0589 -1.4728 0.7275 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3274 -1.4738 1.2063 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0999 -0.2412 0.8124 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5722 -0.3600 0.8872 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8783 -1.7644 1.4503 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1745 0.5809 1.9186 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9201 1.7363 1.3292 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0059 1.3624 0.3755 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.2618 1.2600 1.0123 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7612 0.0455 -0.3147 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6024 -1.0495 0.2319 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2418 0.2553 -1.7671 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2866 -0.2240 -0.4236 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7519 0.8546 -1.3213 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3639 1.3098 -1.0445 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5238 0.2198 -0.4833 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5126 -0.9082 -1.4773 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0946 -0.6161 -0.3382 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9039 -1.5635 0.5235 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0537 -2.9036 -0.1614 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1988 -1.5819 1.3957 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0761 -2.9773 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7497 0.4750 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3946 0.7286 0.5859 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5792 0.9104 1.6798 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4925 2.2397 0.8349 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 2.1754 -2.3161 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0647 2.7352 -0.8176 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3241 1.8084 -2.2731 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 2.2879 -1.6551 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3566 0.6786 -2.3108 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0242 2.3150 1.0091 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2255 1.2855 1.8933 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6958 2.4987 0.7018 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6364 -2.3725 0.9013 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7839 -2.4245 0.8614 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2191 -1.4947 2.3387 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7947 0.5344 1.5795 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8879 -2.5268 0.6579 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1611 -2.0145 2.2906 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8520 -1.7390 2.0292 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8294 0.0940 2.6457 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3276 1.0214 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2594 2.5534 0.9427 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4385 2.2238 2.2111 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1335 2.2101 -0.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3814 2.1511 1.4543 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6119 -1.0692 -0.2902 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9124 -0.8037 1.2922 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 -2.0627 0.1016 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3160 -0.0865 -1.8608 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2464 1.3052 -2.0525 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6848 -0.4204 -2.4542 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2095 -1.2291 -0.9345 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 1.7696 -1.3313 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8524 0.4655 -2.3786 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9116 1.5649 -2.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3795 2.2441 -0.4911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9041 -1.8639 -1.0778 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4729 -1.1261 -1.9015 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -0.6985 -2.3726 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1895 -1.0609 -1.3892 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -1.7946 1.4899 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0239 -3.0218 -0.7039 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1891 -3.0794 -0.8797 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9981 -3.7696 0.5553 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 6 6 7 2 0 6 8 1 0 5 9 1 0 9 10 1 0 10 11 1 0 11 12 1 1 11 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 1 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 23 25 1 0 23 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 6 13 31 1 0 31 32 1 0 32 33 1 0 32 2 1 0 31 5 1 0 29 11 1 0 29 16 1 0 26 17 1 0 1 34 1 0 1 35 1 0 3 36 1 0 3 37 1 0 4 38 1 0 4 39 1 0 8 40 1 0 9 41 1 0 9 42 1 0 10 43 1 0 10 44 1 0 12 45 1 0 12 46 1 0 12 47 1 0 14 48 1 0 15 49 1 0 15 50 1 0 16 51 1 0 18 52 1 0 18 53 1 0 18 54 1 0 19 55 1 0 19 56 1 0 20 57 1 0 20 58 1 0 21 59 1 6 22 60 1 0 24 61 1 0 24 62 1 0 24 63 1 0 25 64 1 0 25 65 1 0 25 66 1 0 26 67 1 0 27 68 1 0 27 69 1 0 28 70 1 0 28 71 1 0 30 72 1 0 30 73 1 0 30 74 1 0 31 75 1 6 32 76 1 1 33 77 1 0 33 78 1 0 33 79 1 0 M END