HMDB0244262 RDKit 3D 1'-Hydroxyestragole 24 24 0 0 0 0 0 0 0 0999 V2000 -2.6738 1.1852 -0.9515 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1379 0.2992 -0.1007 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3199 -0.8585 0.3037 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5312 -1.0827 1.6712 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8708 -0.6645 0.0757 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 0.1493 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1868 0.3524 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8668 -0.2482 -0.2889 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2202 -0.0670 -0.5018 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0411 0.7363 0.2912 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1485 -1.0642 -1.1333 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2167 -1.2760 -0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6786 1.0501 -1.3511 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2437 2.0594 -1.2805 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1226 0.4126 0.3089 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6701 -1.7388 -0.2636 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7835 -0.2202 2.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6414 0.6655 1.7677 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7111 1.0026 1.4269 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9063 1.1134 -0.3237 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5256 0.0667 1.0605 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5398 1.5956 0.7445 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6886 -1.5387 -1.9455 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7804 -1.9293 -1.6369 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 3 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 8 11 1 0 11 12 2 0 12 5 1 0 1 13 1 0 1 14 1 0 2 15 1 0 3 16 1 0 4 17 1 0 6 18 1 0 7 19 1 0 10 20 1 0 10 21 1 0 10 22 1 0 11 23 1 0 12 24 1 0 M END