HMDB0041737 RDKit 3D Genistein 4'-O-glucuronide 50 53 0 0 0 0 0 0 0 0999 V2000 -5.8766 2.4529 -2.4028 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9212 1.2031 -2.5482 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8961 0.6733 -3.3534 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9423 0.3039 -1.8667 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0617 1.1085 -1.1105 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3757 0.3137 -0.1726 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3092 1.0311 0.3013 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9739 0.7616 0.2221 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -0.3652 -0.4006 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8441 -0.6563 -0.4909 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7328 0.2190 0.0639 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1661 -0.0410 -0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7422 -0.4564 -1.1745 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0205 -0.6914 -1.2465 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8185 -0.5461 -0.2183 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1646 -0.8216 -0.3975 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0292 -0.6780 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3920 -0.9517 0.5038 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5528 -0.2664 1.8838 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1983 0.0166 2.0852 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8064 0.4153 3.3083 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3492 -0.1333 1.0085 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0021 0.1198 1.1045 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4628 0.4969 2.1568 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2919 1.3528 0.6917 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 1.6342 0.7782 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3307 0.0220 0.9771 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1670 -1.2924 1.4488 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7378 0.0997 0.4241 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.0057 1.4692 0.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7384 -0.5826 -0.9249 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1536 -1.8456 -0.8687 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8675 -0.2345 -3.7978 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3751 -0.3000 -2.6135 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0603 -0.6029 -0.6826 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1882 -1.0823 -0.8521 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1757 -1.5715 -0.9991 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1195 -0.5903 -2.0522 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5231 -1.1451 -1.3644 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7284 -1.8888 0.6757 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2078 -0.1503 2.7162 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9413 0.6557 3.6562 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0034 2.0435 1.1301 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4004 2.5237 1.2697 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1988 0.7671 1.7712 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4221 -1.2927 2.3996 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4873 -0.3144 1.1188 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6174 2.0302 0.9071 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7774 -0.7030 -1.3228 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 -2.5095 -0.5963 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 2 0 19 20 1 0 20 21 1 0 20 22 2 0 22 23 1 0 23 24 2 0 11 25 1 0 25 26 2 0 6 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 31 4 1 0 26 8 1 0 23 12 1 0 22 15 1 0 3 33 1 0 4 34 1 6 6 35 1 6 9 36 1 0 10 37 1 0 13 38 1 0 16 39 1 0 18 40 1 0 19 41 1 0 21 42 1 0 25 43 1 0 26 44 1 0 27 45 1 1 28 46 1 0 29 47 1 1 30 48 1 0 31 49 1 6 32 50 1 0 M END