HMDB0038808 RDKit 3D Luteolin 3'-(3''-acetylglucuronide) 56 59 0 0 0 0 0 0 0 0999 V2000 6.8607 -0.6429 -3.3911 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6912 -1.0755 -2.6018 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0937 -2.1363 -2.8886 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 -0.3541 -1.5165 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0639 -0.7810 -0.7670 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5519 -1.1367 0.6131 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1339 -2.4110 0.9971 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0485 -0.1385 1.6348 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6709 1.1798 1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9597 2.2050 1.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0447 1.3135 1.5455 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -0.1575 1.6129 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0669 0.1852 0.4340 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4509 1.4209 0.6199 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1366 1.7426 0.6563 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8902 0.8354 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2006 1.2254 0.5549 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2807 0.2693 0.3986 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0718 -1.0714 0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1151 -1.9846 0.0452 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8814 -3.2020 -0.1397 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4067 -1.4946 0.1092 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4975 -2.3072 -0.0251 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3961 -3.6461 -0.2299 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7696 -1.7148 0.0548 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9352 -0.3749 0.2592 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2412 0.1539 0.3291 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8321 0.4155 0.3901 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5479 -0.1400 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5414 0.6907 0.4523 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5157 2.5469 0.7533 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5336 3.4985 0.9079 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2235 3.0761 0.8561 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8036 3.9911 1.0052 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 0.1978 -0.7830 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1125 -0.1479 -1.8697 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7708 -0.8884 -4.4674 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7553 -1.1633 -2.9865 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0632 0.4442 -3.2967 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7298 -1.7516 -1.2373 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6641 -1.1290 0.6896 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6906 -2.7421 1.7454 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3415 -0.6036 2.6322 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5508 2.0615 1.9636 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -0.5844 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6334 -0.2140 0.3508 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -1.4861 0.1396 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7040 -4.3066 -0.3255 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6248 -2.3766 -0.0541 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6539 0.1782 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9544 1.4863 0.5535 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5574 2.8684 0.7923 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7694 4.5558 1.0668 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 3.7859 0.9826 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2438 1.2476 -0.9886 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4829 0.5876 -2.0649 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 6 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 8 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 2 0 23 24 1 0 23 25 1 0 25 26 2 0 26 27 1 0 26 28 1 0 28 29 2 0 29 30 1 0 17 31 2 0 31 32 1 0 32 33 2 0 33 34 1 0 13 35 1 0 35 36 1 0 35 5 1 0 33 15 1 0 30 18 1 0 29 22 1 0 1 37 1 0 1 38 1 0 1 39 1 0 5 40 1 6 6 41 1 6 7 42 1 0 8 43 1 1 11 44 1 0 13 45 1 6 16 46 1 0 19 47 1 0 24 48 1 0 25 49 1 0 27 50 1 0 28 51 1 0 31 52 1 0 32 53 1 0 34 54 1 0 35 55 1 6 36 56 1 0 M END