HMDB0037429 RDKit 3D Astragalin 52 55 0 0 0 0 0 0 0 0999 V2000 0.0090 -2.7625 0.3505 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9614 -1.9452 0.2004 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -0.6318 -0.2503 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -0.2949 -0.5043 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4413 0.1030 0.6212 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2427 -0.9778 0.8302 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5483 -0.9715 0.5865 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8642 -1.8197 -0.6209 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -3.1444 -0.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2019 0.3615 0.4101 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4925 0.4071 0.9099 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4056 1.4587 1.0836 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0562 2.6592 0.8263 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 1.4224 0.3786 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2316 2.4327 0.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7611 0.2229 -0.4082 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 1.5973 -0.8739 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7429 2.4365 -0.6513 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7222 3.7196 -1.1374 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 4.2397 -1.8579 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6776 5.5231 -2.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5922 3.4037 -2.0789 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6222 2.1165 -1.5872 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9752 -0.2335 -0.1143 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2347 -1.4377 0.3064 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5282 -1.8598 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7972 -3.1323 1.0401 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0771 -3.5752 1.3361 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7721 -4.0510 1.2143 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4825 -3.6633 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4414 -4.5562 1.0971 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2298 -2.3829 0.4914 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7132 0.2295 1.4977 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0909 -1.4750 1.4428 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2734 -1.4179 -1.4828 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9482 -1.8276 -0.8801 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3463 -3.3056 0.5303 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2531 0.6288 -0.6629 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8767 1.2995 0.6884 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 1.2191 2.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5771 3.0895 0.0467 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 1.6042 -0.6985 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6765 3.3052 0.7705 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6254 2.1308 -0.0998 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5603 4.4108 -0.9792 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0181 5.8476 -3.1973 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2392 3.7990 -2.6425 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2194 1.5091 -1.8127 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3528 -1.1642 0.4721 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6026 -3.9948 0.5967 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9699 -5.0569 1.5621 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5228 -5.4956 1.4115 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 8 9 1 0 7 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 3 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 20 22 1 0 22 23 2 0 16 24 1 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 1 0 27 29 2 0 29 30 1 0 30 31 1 0 30 32 2 0 32 2 1 0 14 5 1 0 23 17 1 0 32 25 1 0 5 33 1 1 7 34 1 1 8 35 1 0 8 36 1 0 9 37 1 0 10 38 1 6 11 39 1 0 12 40 1 1 13 41 1 0 14 42 1 6 15 43 1 0 18 44 1 0 19 45 1 0 21 46 1 0 22 47 1 0 23 48 1 0 26 49 1 0 28 50 1 0 29 51 1 0 31 52 1 0 M END