HMDB0038030 RDKit 3D 3,3',5,5'-Tetrahydroxy-6,7-methyleneoxy-4'-methoxyflavone 3-glucuronide 58 62 0 0 0 0 0 0 0 0999 V2000 -2.0797 6.2626 -2.0424 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4125 5.1348 -2.5802 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4096 3.8976 -1.9578 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4298 3.5646 -1.0641 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 4.5054 -0.7879 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4232 2.3136 -0.4321 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3919 1.3628 -0.6756 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 0.0412 -0.0638 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5429 -0.6156 -0.1709 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7622 -1.7992 0.3002 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9963 -2.4250 0.1562 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2146 -3.6842 0.6629 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 -4.3310 1.3187 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9173 -3.7464 1.4996 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9899 -4.4851 2.1675 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7591 -2.4868 0.9717 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -1.8472 1.0995 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3877 -2.4200 1.6945 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3441 -0.5530 0.5701 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8793 0.0166 0.7177 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -0.2223 -0.1651 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7968 -1.1106 0.6083 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 -0.3255 1.4331 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0011 -1.0433 2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7248 -0.5349 3.5289 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5627 -2.3427 2.8236 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7625 0.1398 0.5821 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5094 1.1514 1.2036 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2106 0.5703 -0.7498 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3569 -0.3721 -1.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7538 0.9776 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3116 1.3781 -1.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6972 -5.5623 1.7159 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9414 -5.8103 1.0971 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3297 -4.5220 0.6590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 1.7198 -1.5837 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3929 2.9402 -2.2073 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4022 3.2420 -3.1055 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8714 6.2754 -0.9518 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7215 7.1789 -2.5185 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1825 6.1145 -2.1472 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3174 4.3149 -0.1419 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3665 2.1476 0.2782 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7532 -1.8590 -0.3721 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0796 -4.3092 2.4045 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5995 -0.7511 -1.0378 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 0.5696 1.7271 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1559 -2.6714 3.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4963 -0.7090 0.4658 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4353 1.1615 0.8447 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 1.4734 -1.0689 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5742 -1.2712 -1.4438 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7225 1.8211 0.1445 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4694 0.6005 -2.4514 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6964 -6.2305 1.7693 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8108 -6.4239 0.1753 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1523 1.0018 -1.8002 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 2.5870 -3.3229 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 4 6 1 0 6 7 2 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 1 0 14 16 2 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 23 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 13 33 1 0 33 34 1 0 34 35 1 0 7 36 1 0 36 37 2 0 37 38 1 0 37 3 1 0 19 8 2 0 31 21 1 0 16 10 1 0 35 12 1 0 1 39 1 0 1 40 1 0 1 41 1 0 5 42 1 0 6 43 1 0 11 44 1 0 15 45 1 0 21 46 1 0 23 47 1 0 26 48 1 0 27 49 1 0 28 50 1 0 29 51 1 0 30 52 1 0 31 53 1 0 32 54 1 0 34 55 1 0 34 56 1 0 36 57 1 0 38 58 1 0 M END