HMDB0040539 RDKit 3D Kaempferol 3-(6''-acetylgalactoside) 7-rhamnoside 77 81 0 0 0 0 0 0 0 0999 V2000 9.0216 -0.9967 1.8567 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7069 -0.4701 1.4064 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7088 -0.5331 2.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6029 0.0949 0.1511 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4221 0.6229 -0.3825 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3090 -0.3957 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1719 0.1803 -1.0201 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0717 -0.6162 -1.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0568 0.0456 -1.8379 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7944 0.2285 -1.3193 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4289 1.3481 -0.6457 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2713 2.5087 -0.3873 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3977 2.7501 -1.1095 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2233 3.8260 -0.8327 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8752 4.6592 0.2019 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7001 5.7578 0.4995 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7386 4.4386 0.9488 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9416 3.3723 0.6581 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8307 1.3914 -0.1717 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7132 0.4723 -0.3041 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 0.5974 0.2231 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9321 -0.3848 0.0743 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1947 -0.2820 0.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7322 0.7754 1.2922 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8336 1.2621 0.5457 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4726 0.1287 0.0533 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5725 0.6223 -0.8752 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9482 -0.8066 1.0965 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5776 -2.1161 0.7141 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4908 -0.5617 2.4774 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1430 -1.7808 3.1035 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3223 0.3618 2.6235 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2812 -0.2157 3.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 -1.5483 -0.6126 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3346 -1.6517 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9427 -2.8052 -1.8273 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3708 -0.6716 -0.9876 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1123 -0.8342 -1.5175 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1872 -1.8779 -2.1408 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2941 -1.9683 -1.6524 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1474 -1.9663 -3.0365 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6345 -2.5457 -1.3357 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8916 -3.6723 -2.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6930 -1.4890 -1.5093 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9588 -1.9605 -1.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5515 -1.3468 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6051 -0.1796 2.3614 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9051 -1.8078 2.5789 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6431 1.0119 -1.4062 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0399 1.4792 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1330 -0.9222 0.4661 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6098 -0.7710 -0.0273 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7132 2.1550 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1317 4.0283 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4397 5.5749 1.1743 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5125 5.1387 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0521 3.1686 1.2148 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2412 1.4908 0.7451 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0942 1.6338 1.4867 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7208 -0.3675 -0.6222 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3830 1.0047 -0.2094 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1686 1.5377 -1.3978 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9104 -0.1404 -1.5869 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0770 -0.8209 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6175 -2.1343 -0.2698 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3295 -0.1530 3.0856 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6087 -2.5421 2.6581 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5967 1.2998 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7389 -0.8390 2.8157 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3329 -2.3472 -0.7426 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6132 -3.5538 -1.9524 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -2.6581 -1.2112 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9646 -1.0347 -3.3077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6635 -2.8289 -0.2425 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6651 -4.4621 -1.5594 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6034 -1.0850 -2.5542 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8616 -2.8230 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 18 2 0 11 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 22 34 2 0 34 35 1 0 35 36 1 0 35 37 2 0 37 38 1 0 38 39 2 0 8 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 44 6 1 0 38 10 1 0 18 12 1 0 37 20 1 0 32 24 1 0 1 46 1 0 1 47 1 0 1 48 1 0 5 49 1 0 5 50 1 0 6 51 1 0 8 52 1 0 13 53 1 0 14 54 1 0 16 55 1 0 17 56 1 0 18 57 1 0 21 58 1 0 24 59 1 0 26 60 1 0 27 61 1 0 27 62 1 0 27 63 1 0 28 64 1 0 29 65 1 0 30 66 1 0 31 67 1 0 32 68 1 0 33 69 1 0 34 70 1 0 36 71 1 0 40 72 1 0 41 73 1 0 42 74 1 0 43 75 1 0 44 76 1 0 45 77 1 0 M END