HMDB0060141 RDKit 3D rac-4-Hydroxy-4-O-(beta-D-glucuronide)-all-trans-retinyl acetate 77 78 0 0 0 0 0 0 0 0999 V2000 10.3870 -3.1606 1.0685 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6704 -2.1647 0.2057 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5651 -2.4697 -0.3165 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2817 -0.9392 0.0303 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6514 0.0645 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3599 0.3643 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2162 0.2112 -0.8084 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1172 -0.2879 -2.1853 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9593 0.5511 -0.1018 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8092 0.3945 -0.7118 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5372 0.7165 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3551 0.5569 -0.6786 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4219 0.0408 -2.0491 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 0.9085 0.0576 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0706 0.8035 -0.4158 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3461 1.1190 0.2033 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4516 0.8544 -0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3039 0.2988 -1.9016 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7723 1.1033 0.0265 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8089 0.8282 -0.8206 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6455 -0.1130 -0.2837 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.7225 -1.2005 -1.1564 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3979 -2.2666 -0.6296 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4425 -3.3906 -0.4166 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8657 -4.4835 0.0677 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0923 -3.3049 -0.7246 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1567 -1.9906 0.6226 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3984 -2.1448 1.7865 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8664 -0.6726 0.5552 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.0503 -0.2226 1.8694 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0853 0.4017 -0.1673 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1568 1.6286 0.4436 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7468 2.5822 0.4302 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7186 2.7468 1.4653 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6124 1.6976 1.5068 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9831 0.6151 2.5394 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4459 2.4500 2.1428 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9602 -4.1627 0.8545 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2582 -2.8999 2.1336 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4640 -3.2233 0.7675 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3640 0.9368 -0.7293 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6638 -0.3458 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3408 0.7460 0.8372 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0284 -0.3712 -2.7577 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5353 -1.2457 -2.1648 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4694 0.4291 -2.7613 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0116 0.9262 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8103 0.0140 -1.7218 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5721 1.0893 0.9456 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9596 -0.9338 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1276 0.7166 -2.6189 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4506 -0.0272 -2.5261 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 1.2404 1.0558 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0931 0.4053 -1.4681 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7201 1.0443 -2.5183 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7997 -0.6849 -1.8971 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2804 0.2128 -2.4136 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8959 0.4700 0.9403 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2698 -0.4100 0.7108 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1462 -2.5997 -1.4024 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4085 -3.4884 0.0206 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9515 -2.7919 0.6959 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8346 -1.6029 2.4853 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8609 -0.8196 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4869 0.6686 1.7888 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4973 0.4339 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8536 2.3054 -0.2421 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7522 2.9198 0.7467 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5323 3.1320 -0.5234 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2306 3.7528 1.2995 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2084 2.8459 2.4583 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2089 0.5434 3.3447 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9165 0.8721 3.0789 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9892 -0.3944 2.0764 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 1.8398 2.8321 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8964 3.2465 2.8598 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1088 3.0846 1.4404 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 23 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 19 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 35 16 1 0 31 21 1 0 1 38 1 0 1 39 1 0 1 40 1 0 5 41 1 0 5 42 1 0 6 43 1 0 8 44 1 0 8 45 1 0 8 46 1 0 9 47 1 0 10 48 1 0 11 49 1 0 13 50 1 0 13 51 1 0 13 52 1 0 14 53 1 0 15 54 1 0 18 55 1 0 18 56 1 0 18 57 1 0 19 58 1 1 21 59 1 1 23 60 1 6 26 61 1 0 27 62 1 1 28 63 1 0 29 64 1 6 30 65 1 0 31 66 1 6 32 67 1 0 33 68 1 0 33 69 1 0 34 70 1 0 34 71 1 0 36 72 1 0 36 73 1 0 36 74 1 0 37 75 1 0 37 76 1 0 37 77 1 0 M END