HMDB0030266 RDKit 3D Berberrubine 40 44 0 0 0 0 0 0 0 0999 V2000 6.5262 1.6911 0.1858 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7257 0.5492 0.1683 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3336 0.6559 0.1193 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6902 1.8701 0.0864 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3187 1.9723 0.0381 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5585 0.8233 0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1808 0.8863 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5604 -0.2838 -0.0413 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0204 -1.4908 -0.0106 N 0 0 0 0 0 4 0 0 0 0 0 0 1.3951 -1.5592 0.0375 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1572 -0.4164 0.0537 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 -0.4914 0.1025 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2139 -1.6965 0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7036 -2.7180 -0.0252 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1694 -2.6630 -0.0733 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 -1.3242 -0.1064 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1379 -1.2621 -0.1546 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 -0.0483 -0.1883 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 1.1199 -0.1742 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6657 1.0690 -0.1257 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0302 -0.1478 -0.0925 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9408 2.1919 -0.2144 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2501 1.6945 -0.4268 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1350 0.2923 -0.2377 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6350 2.1422 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0875 2.4166 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5331 1.4283 0.5814 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2493 2.7867 0.0976 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8216 2.9280 0.0125 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 1.8543 -0.0506 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8564 -2.5323 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8565 -2.6128 0.1318 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3821 -3.3193 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2894 -3.3391 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6202 -3.2346 -0.9235 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6152 -3.1691 0.8364 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7365 -2.1609 -0.1668 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1312 1.9970 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5440 1.9215 -1.4745 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9111 2.1791 0.2969 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 2 0 10 11 1 0 11 12 2 0 12 13 1 0 9 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 19 22 1 0 22 23 1 0 23 24 1 0 12 3 1 0 21 16 1 0 11 6 1 0 24 18 1 0 21 8 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 5 29 1 0 7 30 1 0 10 31 1 0 13 32 1 0 14 33 1 0 14 34 1 0 15 35 1 0 15 36 1 0 17 37 1 0 20 38 1 0 23 39 1 0 23 40 1 0 M CHG 1 9 1 M END