HMDB0247489 RDKit 3D N-Acetyl-S-(2-carbamoylethyl)-L-cysteine 29 28 0 0 0 0 0 0 0 0999 V2000 -3.6917 2.4874 -0.5105 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 1.9665 0.0547 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4787 2.7332 0.2471 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3238 0.6039 0.3798 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1291 0.0071 0.9415 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5354 -1.0284 0.0151 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9466 -1.7240 0.7875 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2197 -0.4473 0.9199 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6666 -0.0502 -0.4679 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2089 -1.2351 -1.1465 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7224 -1.1232 -2.4565 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2182 -2.3371 -0.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -0.6313 2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6721 -0.6056 2.6434 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4971 -1.2631 2.9426 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4050 2.7062 0.3091 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4907 3.4726 -0.9974 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1818 1.7908 -1.2198 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1236 -0.0356 0.2189 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3543 0.8002 1.0622 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2305 -0.5686 -0.9458 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -1.8293 -0.1982 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8528 0.4294 1.4936 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0988 -0.8632 1.4789 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4193 0.7815 -0.4245 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7458 0.3169 -1.0123 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5673 -1.8937 -3.1345 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2628 -0.2506 -2.7358 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6135 -2.2093 3.2897 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 2 0 5 13 1 0 13 14 2 0 13 15 1 0 1 16 1 0 1 17 1 0 1 18 1 0 4 19 1 0 5 20 1 0 6 21 1 0 6 22 1 0 8 23 1 0 8 24 1 0 9 25 1 0 9 26 1 0 11 27 1 0 11 28 1 0 15 29 1 0 M END