HMDB0030258 RDKit 3D (+)-Erythraline 41 45 0 0 0 0 0 0 0 0999 V2000 -3.9988 1.9614 2.0657 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7005 2.2765 1.6805 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3209 1.4533 0.6577 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0475 2.2086 -0.6082 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5367 1.4267 -1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3088 0.0004 -1.2766 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5138 -1.1352 -1.8993 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -2.3203 -1.0789 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0996 -1.7097 0.2573 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2707 -2.5155 1.1003 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -2.7296 0.6049 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -1.4217 0.1471 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0217 -1.2472 -0.0462 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5669 -0.0609 -0.4712 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7333 1.0230 -0.7266 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3826 0.8766 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8352 -0.3537 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6585 -0.3663 0.0485 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0751 0.6659 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5795 2.0508 -1.1322 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9151 1.7590 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 0.3335 -0.7253 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0816 0.9008 2.4155 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 2.0550 1.1578 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3892 2.6451 2.8427 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1688 0.7591 0.4238 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2087 3.2199 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2884 1.7700 -2.5224 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9623 -1.1639 -2.9046 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0917 -2.6768 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8372 -3.1078 -1.0829 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7864 -3.5091 1.1853 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1815 -2.0811 2.1268 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7071 -3.0999 1.4962 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2276 -3.5206 -0.1685 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6323 -2.1211 0.1659 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7651 1.7331 -0.7512 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1907 0.2555 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2636 1.4581 1.0252 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0299 2.1585 0.3212 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6668 2.1494 -1.4148 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 15 20 1 0 20 21 1 0 21 22 1 0 19 3 1 0 18 6 1 0 18 9 1 0 17 12 1 0 22 14 1 0 1 23 1 0 1 24 1 0 1 25 1 0 3 26 1 0 4 27 1 0 5 28 1 0 7 29 1 0 8 30 1 0 8 31 1 0 10 32 1 0 10 33 1 0 11 34 1 0 11 35 1 0 13 36 1 0 16 37 1 0 19 38 1 0 19 39 1 0 21 40 1 0 21 41 1 0 M END