HMDB0041712 RDKit 3D cis-Resveratrol 3-sulfate 33 34 0 0 0 0 0 0 0 0999 V2000 5.1212 -2.5540 -0.7472 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3050 -1.0702 -0.5952 S 0 0 0 0 0 6 0 0 0 0 0 0 6.6186 -0.7233 -1.2366 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 -0.6737 1.0487 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0185 -0.2311 -1.3044 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8195 -0.0594 -0.6287 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5951 1.0333 0.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3973 1.1563 0.8275 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1842 2.2607 1.6407 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4068 0.2032 0.6806 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5735 -0.8886 -0.1057 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3535 -1.9247 -0.4436 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6329 -1.8401 -0.5318 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4256 -0.6623 -0.3365 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6935 -0.8816 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6326 0.0893 0.3632 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3652 1.3640 -0.0502 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3111 2.3921 0.0813 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1285 1.5973 -0.6014 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1737 0.6116 -0.7465 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8247 -0.9904 -0.7608 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4473 0.3206 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3392 1.8023 0.3267 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 2.9513 1.7434 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5128 0.3071 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -2.9626 -0.6562 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2079 -2.8023 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9715 -1.8881 0.5752 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5958 -0.1461 0.8047 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9804 2.6124 -0.6184 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8825 2.6134 -0.9443 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2269 0.8239 -1.2366 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0333 -1.8403 -1.4078 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 1 0 8 10 2 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 17 19 1 0 19 20 2 0 11 21 2 0 21 6 1 0 20 14 1 0 4 22 1 0 7 23 1 0 9 24 1 0 10 25 1 0 12 26 1 0 13 27 1 0 15 28 1 0 16 29 1 0 18 30 1 0 19 31 1 0 20 32 1 0 21 33 1 0 M END