HMDB0248468 RDKit 3D Anthraquinone 24 26 0 0 0 0 0 0 0 0999 V2000 0.2369 -2.6339 0.0346 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1361 -1.3882 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1693 -0.7832 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2821 -1.5721 0.4619 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5155 -0.9784 0.6705 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6882 0.3918 0.6882 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5619 1.1841 0.4859 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3271 0.5893 0.2771 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1342 1.3975 0.0631 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2681 2.6558 0.0751 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1913 0.8046 -0.1615 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3077 1.5709 -0.3618 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5318 0.9599 -0.5686 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6837 -0.4107 -0.5828 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5577 -1.1816 -0.3807 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3334 -0.5680 -0.1739 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2369 -2.6592 0.4637 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 -1.5837 0.8321 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 0.8567 0.8501 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6388 2.2627 0.4896 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1847 2.6443 -0.3501 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4144 1.5504 -0.7269 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6757 -0.8572 -0.7508 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6317 -2.2517 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 2 1 0 8 3 1 0 16 11 1 0 4 17 1 0 5 18 1 0 6 19 1 0 7 20 1 0 12 21 1 0 13 22 1 0 14 23 1 0 15 24 1 0 M END