HMDB0256303 RDKit 3D Peramine 35 36 0 0 0 0 0 0 0 0999 V2000 -0.8879 -1.5033 2.1326 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6644 -0.6832 1.1902 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0865 0.3087 0.4907 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3604 0.6148 0.6428 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2036 -0.1767 -0.3365 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6537 0.2183 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5429 -0.4979 -0.9894 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9418 -0.3151 -0.9669 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5315 0.5464 -1.7074 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7451 -1.1050 -0.0982 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8657 1.0455 -0.3795 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1911 0.7927 -0.5431 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1452 1.3698 -1.3244 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3535 0.7369 -1.1218 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1035 -0.2477 -0.1884 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7669 -0.2006 0.1582 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9771 -0.9341 1.0287 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5325 -1.8521 1.6701 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2752 -2.2536 1.6147 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5814 -2.0537 2.8003 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2888 -0.8440 2.8156 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7296 0.4981 1.6673 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5045 1.6964 0.3528 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1419 -1.2590 -0.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9133 0.0490 -1.3704 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8341 1.2899 -0.2357 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9689 -0.0577 0.9385 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1398 -1.1629 -1.6701 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0077 1.1710 -2.3786 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8385 -2.1074 -0.2946 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2370 -0.6768 0.7316 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4325 1.8507 -0.9578 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0099 2.1834 -1.9966 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3136 0.9701 -1.6043 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8186 -0.9313 0.2017 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 1 0 6 7 1 0 7 8 1 0 8 9 2 3 8 10 1 0 3 11 2 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 17 2 1 0 16 12 1 0 1 19 1 0 1 20 1 0 1 21 1 0 4 22 1 0 4 23 1 0 5 24 1 0 5 25 1 0 6 26 1 0 6 27 1 0 7 28 1 0 9 29 1 0 10 30 1 0 10 31 1 0 11 32 1 0 13 33 1 0 14 34 1 0 15 35 1 0 M END