HMDB0034008 RDKit 3D Methylnissolin 38 41 0 0 0 0 0 0 0 0999 V2000 -5.8129 0.2063 0.1651 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6429 -0.4842 -0.1698 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3709 -0.0119 0.1348 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1999 1.1887 0.7974 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9273 1.6575 1.1001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8296 0.9095 0.7311 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9622 -0.2914 0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2431 -0.7244 -0.2136 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3927 -1.9480 -0.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4331 -2.0158 -2.3003 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3148 -0.8331 -0.1795 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1438 -0.2971 0.8628 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5692 -0.3968 0.5522 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2798 -1.5061 0.9778 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6414 -1.6443 0.7045 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3006 -0.6608 -0.0033 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6437 -0.8057 -0.2682 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5733 0.4297 -0.4143 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2253 0.5893 -0.1563 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4923 1.6770 -0.5643 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 1.8812 -0.3105 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6289 1.1248 0.8996 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0878 -0.0848 1.1994 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7018 1.2914 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6078 -0.1141 -0.5652 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0386 1.8006 1.1014 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8384 2.6078 1.6228 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3368 -1.0380 -2.7842 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3575 -2.5686 -2.5706 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5812 -2.6757 -2.6007 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -0.8285 1.7829 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7851 -2.2861 1.5319 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2112 -2.5064 1.0308 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 -0.1693 -0.7638 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0674 1.2084 -0.9676 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5597 1.5012 -1.1978 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8682 2.9515 -0.2156 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8729 1.6438 1.8442 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 7 11 1 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 16 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 8 3 1 0 22 12 1 0 22 6 1 0 19 13 1 0 1 23 1 0 1 24 1 0 1 25 1 0 4 26 1 0 5 27 1 0 10 28 1 0 10 29 1 0 10 30 1 0 12 31 1 0 14 32 1 0 15 33 1 0 17 34 1 0 18 35 1 0 21 36 1 0 21 37 1 0 22 38 1 0 M END