HMDB0301556 RDKit 3D 4-amino-3-hydroxybutanoyl-CoA 98100 0 0 0 0 0 0 0 0999 V2000 1.8865 -3.3771 -0.3202 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1767 -2.1639 -0.8025 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0383 -2.6235 -1.7122 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6213 -1.4298 0.3944 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0446 -0.2963 -0.0785 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7154 0.5992 1.1656 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.4979 -0.0527 2.5156 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 2.1122 1.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3767 0.8230 0.8929 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2915 -0.1760 1.8693 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.6431 -1.5633 1.8043 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1902 0.2715 3.5154 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8692 -0.2581 1.3422 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1988 0.6093 0.3207 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6813 0.3408 0.0186 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0484 1.1880 -1.0017 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5545 2.3545 -0.5001 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8003 2.6415 -1.2278 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3256 3.8251 -1.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4806 3.6220 -2.2237 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7187 2.2995 -2.3209 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7565 1.6005 -2.8965 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8624 2.2029 -3.5491 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6994 0.2594 -2.8235 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.6557 -0.3453 -2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6446 0.3452 -1.6442 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6457 1.7014 -1.6857 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8125 2.2085 0.9716 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9163 3.0320 1.6505 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5169 0.7473 1.2157 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6200 -0.0375 1.3935 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6573 -0.8328 2.8746 P 0 0 0 0 0 5 0 0 0 0 0 0 -9.9887 -1.4087 3.1993 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0671 0.1973 4.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5548 -2.1337 2.7487 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0218 -1.2040 -1.6147 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1654 -0.1473 -1.9654 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0967 -0.6727 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0282 0.4882 -0.2605 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1927 -1.5087 -0.4174 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2413 -1.0050 0.4588 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2886 -2.0600 0.6497 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3539 -1.5520 1.5523 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3341 -0.3558 1.8849 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3449 -2.4455 2.0014 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4285 -2.0996 2.8483 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5059 -1.2906 2.2765 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0732 0.2241 1.4834 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4997 0.0728 -0.1978 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4268 -1.0009 -0.7717 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1067 1.3534 -0.8875 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3768 2.1345 -1.1436 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0629 3.3560 -1.7788 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2957 1.3253 -2.0195 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6820 0.0731 -1.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0796 -4.0780 0.0603 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -3.9139 -1.1314 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5219 -3.2189 0.5822 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4835 -3.2545 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5011 -1.7731 -2.1409 H 0 0 0 0 0 0 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-2.4770 -0.8202 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 -0.0733 0.1053 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7472 -0.7583 1.4294 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7228 -2.3860 -0.3225 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8408 -2.9873 1.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2928 -3.4716 1.6905 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0339 -1.5230 3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8785 -3.0303 3.3297 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2662 -1.0485 3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0873 -1.9757 1.5533 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6087 1.0725 -1.8476 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3864 1.9229 -0.2795 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8779 2.2845 -0.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4344 4.0944 -1.2432 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8127 1.1248 -3.0214 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1868 1.9562 -2.2652 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9898 -0.5891 -2.2082 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3577 0.1913 -0.6875 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 6 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 10 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 22 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 17 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 31 32 1 0 32 33 2 0 32 34 1 0 32 35 1 0 2 36 1 0 36 37 1 0 36 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 2 0 43 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 49 51 1 0 51 52 1 0 52 53 1 0 52 54 1 0 54 55 1 0 30 15 1 0 27 18 1 0 27 21 1 0 1 56 1 0 1 57 1 0 1 58 1 0 3 59 1 0 3 60 1 0 3 61 1 0 4 62 1 0 4 63 1 0 8 64 1 0 12 65 1 0 14 66 1 0 14 67 1 0 15 68 1 0 17 69 1 0 19 70 1 0 23 71 1 0 23 72 1 0 25 73 1 0 28 74 1 0 29 75 1 0 30 76 1 0 34 77 1 0 35 78 1 0 36 79 1 0 37 80 1 0 40 81 1 0 41 82 1 0 41 83 1 0 42 84 1 0 42 85 1 0 45 86 1 0 46 87 1 0 46 88 1 0 47 89 1 0 47 90 1 0 51 91 1 0 51 92 1 0 52 93 1 0 53 94 1 0 54 95 1 0 54 96 1 0 55 97 1 0 55 98 1 0 M END