HMDB0037927 RDKit 3D Quercetin 7-xyloside 49 52 0 0 0 0 0 0 0 0999 V2000 1.8327 4.3287 0.0027 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8005 3.0857 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 2.4051 -0.5804 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0764 3.1791 -0.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9834 1.0539 -0.7802 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1434 0.2979 -1.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3654 0.8183 -1.4726 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 0.0194 -1.8846 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3060 -1.3335 -2.0357 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3646 -2.1433 -2.4425 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0684 -1.8728 -1.7691 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9201 -3.2454 -1.9213 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0146 -1.0852 -1.3667 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8335 0.4165 -0.5533 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7282 0.9866 -0.1672 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4105 0.1793 0.0323 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6057 0.7118 0.4378 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7568 -0.0134 0.6524 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -1.3764 0.5031 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -1.5812 -0.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9873 -0.7509 -0.3098 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4217 -0.6448 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1816 0.6169 1.6709 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8788 -1.7135 2.0064 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7362 -2.8240 1.9863 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4538 -2.0734 1.7361 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4354 -3.4546 1.4244 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6354 2.0649 0.6383 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5248 2.9100 0.4518 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6484 4.2421 0.6752 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6638 2.3520 0.0445 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0869 4.1726 -0.6415 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5594 1.8691 -1.3786 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4105 0.4493 -2.0905 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2626 -1.7448 -2.6351 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0268 -3.7064 -1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0359 -1.5228 -1.1574 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3301 -0.8705 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0337 -1.9401 0.1782 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7822 -1.1031 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 0.2632 -0.6657 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5458 -0.7562 1.1223 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1430 1.3239 0.9829 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9446 -1.3206 3.0635 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4783 -2.6546 1.3618 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7896 -1.9508 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0637 -3.5746 0.6648 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 2.5466 0.9621 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0351 4.9639 0.6085 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 3 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 9 11 1 0 11 12 1 0 11 13 2 0 5 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 17 28 2 0 28 29 1 0 29 30 1 0 29 31 2 0 31 2 1 0 13 6 1 0 31 15 1 0 26 19 1 0 4 32 1 0 7 33 1 0 8 34 1 0 10 35 1 0 12 36 1 0 13 37 1 0 16 38 1 0 19 39 1 0 21 40 1 0 21 41 1 0 22 42 1 0 23 43 1 0 24 44 1 0 25 45 1 0 26 46 1 0 27 47 1 0 28 48 1 0 30 49 1 0 M END