HMDB0254935 RDKit 3D 6,6'-Methylenebis(2,2-dimethyl-4-methanesulfonic acid-1,2-dihydroquinoline) 65 68 0 0 0 0 0 0 0 0999 V2000 5.5465 0.7955 -2.4939 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2536 -0.3463 -1.5436 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4173 -1.3380 -1.6016 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2183 0.1589 -0.1479 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2446 0.0102 0.7035 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2784 0.5397 2.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7830 1.3826 2.3877 S 0 0 0 0 0 6 0 0 0 0 0 0 6.9806 0.4796 2.3126 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8036 1.9652 3.7978 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0475 2.6896 1.3676 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0435 -0.7370 0.2478 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9819 -0.9258 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8436 -1.6098 0.7378 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3162 -1.8339 1.6267 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3185 -0.7546 1.5304 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3539 0.3751 2.2979 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3458 1.3377 2.1257 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 1.1664 1.1729 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2964 0.0308 0.3893 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3186 -0.9070 0.5636 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2876 -0.1288 -0.6886 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3378 -1.2984 -1.5762 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9039 -2.7878 -0.8066 S 0 0 0 0 0 6 0 0 0 0 0 0 -4.2706 -3.1413 0.4768 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4233 -2.6059 -0.5489 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8654 -4.0657 -1.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1701 0.8422 -0.8855 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2624 2.0974 -0.1158 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0102 3.2349 -1.1091 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7063 2.2472 0.3275 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3454 2.1441 0.9813 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7922 -2.1136 -0.5422 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8324 -1.9462 -1.4292 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 -1.2487 -1.0328 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0656 -1.0599 -1.9256 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6537 0.9995 -2.4593 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3082 0.5485 -3.5356 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0609 1.7285 -2.1416 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1313 -2.3209 -1.1897 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7152 -1.4080 -2.6763 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2517 -0.8582 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1113 0.7154 0.1973 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3826 1.1007 2.3609 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2802 -0.3643 2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3509 3.3844 1.4709 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0411 -0.5298 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8337 -2.7905 1.3658 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0067 -1.9585 2.6902 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 0.4984 3.0464 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3785 2.2296 2.7262 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2913 -1.7668 -0.0963 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0535 -1.0930 -2.4092 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3635 -1.4624 -2.1066 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3610 -3.7979 -2.7353 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9002 0.7145 -1.6853 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9573 3.3789 -1.6755 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2567 2.9162 -1.8672 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6435 4.1421 -0.6207 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9892 3.3273 0.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8248 1.9401 1.3903 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3661 1.6245 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 2.9100 1.6702 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1071 -2.6633 -0.8573 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7836 -2.3452 -2.4323 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0053 -1.4482 -2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 2 0 7 10 1 0 5 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 2 0 23 26 1 0 21 27 2 0 27 28 1 0 28 29 1 0 28 30 1 0 28 31 1 0 13 32 2 0 32 33 1 0 33 34 2 0 34 35 1 0 35 2 1 0 34 11 1 0 20 15 1 0 31 18 1 0 1 36 1 0 1 37 1 0 1 38 1 0 3 39 1 0 3 40 1 0 3 41 1 0 4 42 1 0 6 43 1 0 6 44 1 0 10 45 1 0 12 46 1 0 14 47 1 0 14 48 1 0 16 49 1 0 17 50 1 0 20 51 1 0 22 52 1 0 22 53 1 0 26 54 1 0 27 55 1 0 29 56 1 0 29 57 1 0 29 58 1 0 30 59 1 0 30 60 1 0 30 61 1 0 31 62 1 0 32 63 1 0 33 64 1 0 35 65 1 0 M END