HMDB0001173 RDKit 3D 5'-Methylthioadenosine 35 37 0 0 0 0 0 0 0 0999 V2000 4.4626 1.1326 1.3832 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4701 -0.6001 0.9338 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8655 -1.3757 0.8284 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0637 -0.9271 -0.3377 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8087 -1.5720 -0.3589 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0279 -0.8829 -1.2498 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3744 -0.9365 -0.9378 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2684 -1.8240 -1.3948 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4937 -1.5767 -0.8970 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -0.4975 -0.1001 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2444 0.2267 0.6773 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6099 -0.1528 0.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7931 1.2822 1.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5081 1.6274 1.3173 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6454 0.9388 0.5712 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0495 -0.1107 -0.1338 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5674 0.4833 -1.4099 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2012 0.5978 -2.6666 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6904 0.5135 -0.3964 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7396 1.3169 -0.8641 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9580 1.7565 0.5921 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1443 1.3005 2.2829 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5009 1.5396 1.7063 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0524 -2.4881 0.7301 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -1.2830 1.7937 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5917 -1.1499 -1.3126 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1419 -1.4348 -2.2337 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -2.6490 -2.0768 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3164 0.3126 0.1126 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9060 -0.9045 1.3878 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1943 2.5005 1.9096 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 1.2984 -1.2586 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5513 0.4632 -3.3993 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3477 0.8291 0.6124 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5092 2.2458 -0.5511 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 11 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 6 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 19 4 1 0 16 7 1 0 16 10 1 0 1 21 1 0 1 22 1 0 1 23 1 0 3 24 1 0 3 25 1 0 4 26 1 6 6 27 1 6 8 28 1 0 12 29 1 0 12 30 1 0 14 31 1 0 17 32 1 1 18 33 1 0 19 34 1 1 20 35 1 0 M END