HMDB0257166 RDKit 3D Resorufin 23 25 0 0 0 0 0 0 0 0999 V2000 -4.5911 0.0516 -2.0372 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6256 -0.1026 -1.2398 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -0.6524 0.0204 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7491 -0.8046 0.8661 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4748 -0.4352 0.5097 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3884 -0.5562 1.2776 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8436 -0.1720 0.8666 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -0.3197 1.7016 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1972 0.0842 1.2558 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3434 0.6215 -0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 1.0163 -0.4304 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2368 0.7524 -0.8034 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9695 0.3648 -0.3991 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0916 0.4896 -1.1656 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2958 0.1367 -0.8192 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3819 0.2931 -1.6743 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8019 -0.9615 0.3629 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8997 -1.2291 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8672 -0.7354 2.6954 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0502 -0.0261 1.8965 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9607 1.9461 -0.2876 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3161 1.1698 -1.7956 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1758 0.7233 -2.6431 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 10 11 1 0 10 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 0 16 2 1 0 15 5 1 0 13 7 1 0 3 17 1 0 4 18 1 0 8 19 1 0 9 20 1 0 11 21 1 0 12 22 1 0 16 23 1 0 M END