HMDB0240502 RDKit 3D Dihydroresveratrol 4'-sulfate 35 36 0 0 0 0 0 0 0 0999 V2000 5.5636 0.3897 -1.8108 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1879 0.6618 -0.4604 S 0 0 0 0 0 6 0 0 0 0 0 0 7.4086 -0.2341 -0.3746 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6642 2.2442 -0.4172 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1371 0.2340 0.7792 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7561 0.1505 0.5049 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9387 1.2477 0.6539 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6011 1.1146 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0146 -0.0607 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4215 -0.0589 -0.3132 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2719 -0.4081 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7032 -0.3518 0.4032 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4534 0.7878 0.4637 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7726 0.7831 0.0142 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5322 1.9484 0.0786 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3458 -0.3657 -0.4984 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5766 -1.5122 -0.5543 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1476 -2.6506 -1.0634 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2842 -1.4957 -0.1107 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8413 -1.1467 -0.1963 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1845 -1.0263 0.0811 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5113 2.4117 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3817 2.1748 0.9864 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0055 2.0307 0.5143 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6508 -0.7276 -1.1817 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7183 0.9565 -0.6485 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1853 0.3579 1.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1164 -1.4055 1.2737 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9952 1.6836 0.8672 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5143 2.5693 -0.7121 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3710 -0.3735 -0.8489 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6365 -3.5346 -1.1343 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7009 -2.4009 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3968 -2.0844 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8047 -1.9087 -0.0455 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 2 0 2 4 1 0 2 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 14 16 2 0 16 17 1 0 17 18 1 0 17 19 2 0 9 20 1 0 20 21 2 0 21 6 1 0 19 12 1 0 4 22 1 0 7 23 1 0 8 24 1 0 10 25 1 0 10 26 1 0 11 27 1 0 11 28 1 0 13 29 1 0 15 30 1 0 16 31 1 0 18 32 1 0 19 33 1 0 20 34 1 0 21 35 1 0 M END