HMDB0041785 RDKit 3D Tyrosol 4-sulfate 24 24 0 0 0 0 0 0 0 0999 V2000 3.9564 1.8840 1.8685 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6856 0.6026 1.1063 S 0 0 0 0 0 6 0 0 0 0 0 0 2.7975 -0.2680 1.9719 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1191 -0.2200 0.7838 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8696 1.0035 -0.3125 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5269 0.6807 -0.4716 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1316 -0.5212 -1.0214 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2052 -0.8240 -1.1714 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1804 0.0718 -0.7734 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6268 -0.1983 -0.9096 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1562 -0.8807 0.3309 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9731 -0.0943 1.4665 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7624 1.2700 -0.2251 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5688 1.5977 -0.0639 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0683 -0.7334 -0.0607 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9041 -1.2131 -1.3286 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4906 -1.7572 -1.5981 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8733 -0.8457 -1.7755 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1527 0.7618 -1.0351 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5939 -1.8325 0.5157 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 -1.0697 0.1805 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7480 -0.2752 2.0593 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5099 2.0036 0.1013 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8827 2.5286 0.3621 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 9 13 1 0 13 14 2 0 14 6 1 0 4 15 1 0 7 16 1 0 8 17 1 0 10 18 1 0 10 19 1 0 11 20 1 0 11 21 1 0 12 22 1 0 13 23 1 0 14 24 1 0 M END