HMDB0301953 RDKit 3D trans-p-Ferulyl alcohol 4-O-[6-(2-methyl-3-hydroxypropionyl)] glucopyranoside 58 59 0 0 0 0 0 0 0 0999 V2000 2.3528 -1.4901 3.9404 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7925 -1.3067 2.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4549 -0.6003 1.6837 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -0.0490 1.9104 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 0.6672 0.9234 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6777 1.2246 1.2297 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3795 1.9090 0.3571 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7354 2.4670 0.7314 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7567 3.8339 0.6143 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7304 0.7836 -0.2791 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4662 0.2212 -0.5146 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7906 -0.4842 0.4505 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5495 -1.0627 0.2904 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2162 -1.0252 -0.8723 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4456 -0.3508 -0.6625 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9509 -0.0580 -1.9144 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9873 1.0094 -1.9663 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1544 0.7786 -1.2455 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2004 0.6370 0.1205 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1907 0.7078 0.8549 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5201 0.3873 0.7501 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4543 1.5168 0.4563 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4219 0.1866 2.2316 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8794 1.3074 2.8517 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 -1.3693 -2.5031 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1350 -1.1945 -3.6785 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1847 -2.2087 -2.7671 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4769 -3.4136 -3.3573 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5018 -2.4147 -1.4226 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7220 -3.0136 -1.6681 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -0.5270 4.5122 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8034 -2.2707 4.5026 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4076 -1.7853 3.9119 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1992 -0.1479 2.8808 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1426 1.0999 2.2101 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9785 2.0697 -0.6314 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4422 1.9707 0.0031 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9942 2.0697 1.7145 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6041 4.2024 0.2648 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1991 1.3238 -1.0857 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0055 0.3516 -1.5042 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -0.4771 -1.7113 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0796 0.2447 -2.5668 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2878 1.1539 -3.0466 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5077 1.9804 -1.6759 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9691 -0.5380 0.3155 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9122 2.4485 0.1423 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1773 1.2881 -0.3587 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0164 1.7891 1.3687 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4519 0.0728 2.6224 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7935 -0.7210 2.4652 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6596 2.0200 2.1782 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -1.9209 -1.7455 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0965 -2.0478 -4.1968 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5034 -1.5813 -3.4047 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2924 -3.8045 -3.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1481 -3.0095 -0.7728 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3224 -2.8502 -0.8965 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 2 0 7 8 1 0 8 9 1 0 5 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 16 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 12 3 1 0 29 14 1 0 1 31 1 0 1 32 1 0 1 33 1 0 4 34 1 0 6 35 1 0 7 36 1 0 8 37 1 0 8 38 1 0 9 39 1 0 10 40 1 0 11 41 1 0 14 42 1 6 16 43 1 6 17 44 1 0 17 45 1 0 21 46 1 0 22 47 1 0 22 48 1 0 22 49 1 0 23 50 1 0 23 51 1 0 24 52 1 0 25 53 1 1 26 54 1 0 27 55 1 6 28 56 1 0 29 57 1 1 30 58 1 0 M END