HMDB0127983 RDKit 3D 6-[3-(2-carboxyeth-1-en-1-yl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid 40 41 0 0 0 0 0 0 0 0999 V2000 6.3408 1.3985 -0.3687 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 0.2107 -0.4914 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0235 -0.0417 -0.7304 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7363 -0.8874 -0.4216 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4911 -1.1058 -0.2211 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3111 -0.3171 0.0522 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3208 0.9922 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1216 1.6954 0.5873 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9156 1.0670 0.4104 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8488 -0.2613 0.0529 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3049 -0.9507 -0.1392 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6182 -0.5375 -0.0365 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2442 -0.6101 -1.2786 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3916 0.1598 -1.3385 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1117 1.4979 -1.9226 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9809 1.8687 -2.3069 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 2.3918 -2.0495 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0259 0.3805 0.0109 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6814 1.6147 0.5728 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8314 -0.7602 0.9508 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6975 -1.8246 0.6401 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4183 -1.2747 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3966 -2.6457 0.8497 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0395 -0.9136 -0.1156 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6289 0.1036 0.0604 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3189 -1.8936 -0.6032 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2287 -2.2405 -0.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2414 1.5066 0.5881 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2044 2.7455 0.8701 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0188 1.6481 0.5607 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6394 0.5337 0.2511 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1143 -0.3411 -2.0123 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8052 2.4128 -2.8244 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1387 0.4573 -0.1749 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2136 1.6992 1.3998 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1783 -0.4050 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3470 -1.4825 -0.0231 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9996 -0.9922 1.9995 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1482 -2.9439 -0.0519 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0426 -1.9546 -0.3989 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 3 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 14 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 10 24 2 0 24 6 1 0 22 12 1 0 3 25 1 0 4 26 1 0 5 27 1 0 7 28 1 0 8 29 1 0 9 30 1 0 12 31 1 0 14 32 1 0 17 33 1 0 18 34 1 0 19 35 1 0 20 36 1 0 21 37 1 0 22 38 1 0 23 39 1 0 24 40 1 0 M END