HMDB0003332 RDKit 3D 3-Methoxy-4-Hydroxyphenylglycol sulfate 29 29 0 0 0 0 0 0 0 0999 V2000 2.9357 0.4030 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2757 -0.1243 1.1215 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2865 -0.2679 0.1639 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9927 0.0972 0.4371 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0255 -0.0559 -0.5342 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3876 0.3133 -0.3218 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4893 1.8181 -0.4325 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8261 2.2257 -0.2226 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -0.1518 0.9169 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0461 -1.2365 0.8397 S 0 0 0 0 0 6 0 0 0 0 0 0 -2.6487 -2.5154 0.1297 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3954 -1.6298 2.2479 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3983 -0.6010 0.1079 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -0.5749 -1.7556 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6844 -0.9456 -2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6483 -0.7899 -1.0715 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9659 -1.1345 -1.2745 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0329 -0.1543 2.7608 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7746 0.2186 3.1143 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7113 1.4902 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6767 0.5064 1.3873 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9888 -0.1217 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2375 2.1715 -1.4528 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7941 2.3247 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3299 1.8814 -1.0131 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9809 -0.1278 0.7709 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3446 -0.7083 -2.5449 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9771 -1.3539 -3.0088 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 -1.5185 -2.1657 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 1 0 6 7 1 0 7 8 1 0 6 9 1 0 9 10 1 0 10 11 2 0 10 12 2 0 10 13 1 0 5 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 16 3 1 0 1 18 1 0 1 19 1 0 1 20 1 0 4 21 1 0 6 22 1 0 7 23 1 0 7 24 1 0 8 25 1 0 13 26 1 0 14 27 1 0 15 28 1 0 17 29 1 0 M END