HMDB0034051 RDKit 3D 6-Galloylglucose 39 40 0 0 0 0 0 0 0 0999 V2000 0.3817 -1.1990 -0.4702 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0312 -0.1298 -0.5224 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3423 1.0380 -0.6309 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0004 1.3286 -0.6804 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8481 1.1752 0.5301 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1454 1.5160 0.1207 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1771 0.8374 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3444 1.2667 -0.0687 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1414 -0.6640 0.5691 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8746 -1.1288 -0.5339 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7191 -1.1304 0.4503 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 -2.4210 0.9118 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8858 -0.1175 1.2314 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6385 0.0471 2.4465 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 -0.1596 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2682 0.9797 -0.5192 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6692 0.9297 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3816 2.1338 -0.5236 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3264 -0.2728 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7098 -0.3582 -0.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5369 -1.4229 -0.3011 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1711 -2.6504 -0.1902 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1606 -1.3639 -0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0608 2.4153 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5171 0.7948 -1.5494 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4897 1.9735 1.2808 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4163 1.2056 1.6991 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5697 2.1823 0.1569 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5439 -1.1245 1.5057 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1059 -0.3481 -1.0902 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3519 -1.0914 -0.6072 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7891 -3.0332 0.1595 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9477 -0.5374 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 0.5182 3.0461 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7673 1.9293 -0.6053 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3692 2.2043 -0.4923 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3103 0.4453 -0.3322 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6286 -3.5036 -0.1494 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5545 -2.2645 -0.3141 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 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 2 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 2 0 19 20 1 0 19 21 1 0 21 22 1 0 21 23 2 0 13 5 1 0 23 15 1 0 4 24 1 0 4 25 1 0 5 26 1 0 7 27 1 0 8 28 1 0 9 29 1 0 10 30 1 0 11 31 1 0 12 32 1 0 13 33 1 0 14 34 1 0 16 35 1 0 18 36 1 0 20 37 1 0 22 38 1 0 23 39 1 0 M END