HMDB0134109 RDKit 3D 6-(3-carboxy-4-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid 37 38 0 0 0 0 0 0 0 0999 V2000 6.1648 1.6339 0.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9433 1.8088 0.2039 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4947 3.1198 0.3396 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 0.7111 0.0799 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6255 0.9900 0.0988 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6507 0.0238 -0.0115 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3307 0.3817 0.0161 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -0.4346 -0.0793 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5531 -0.2088 1.0566 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8819 -0.4613 0.9678 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2034 -1.9183 0.8865 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2861 -2.7763 0.9035 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5059 -2.3816 0.7902 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5949 0.2784 -0.1399 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5537 1.1711 0.3357 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5426 1.0376 -0.9302 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8994 1.9055 -0.0486 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5214 -0.0128 -1.3464 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2431 -1.1123 -1.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0959 -1.2721 -0.1456 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4404 -1.5631 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 -0.5810 -0.0538 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7514 -0.9904 -0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6775 3.3772 0.8766 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3002 2.0220 0.2058 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5546 -1.5062 -0.1904 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3524 -0.1075 1.9165 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0474 -2.3480 1.6652 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 -0.4490 -0.7908 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4941 2.0332 -0.1429 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9769 1.5658 -1.8024 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3716 1.9992 0.8046 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8523 0.4133 -2.0991 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2678 -1.1776 -2.7823 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3459 -2.0721 -0.2365 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7593 -2.6004 -0.2736 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5966 -0.4990 -0.0282 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 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 10 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 6 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 22 4 1 0 18 8 1 0 3 24 1 0 5 25 1 0 8 26 1 0 10 27 1 0 13 28 1 0 14 29 1 0 15 30 1 0 16 31 1 0 17 32 1 0 18 33 1 0 19 34 1 0 20 35 1 0 21 36 1 0 23 37 1 0 M END