HMDB0242039 RDKit 3D N-Lauroyl Proline 52 52 0 0 0 0 0 0 0 0999 V2000 7.5100 1.4070 -3.0513 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3402 1.0302 -3.9132 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0025 1.2882 -3.2519 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8468 0.5244 -1.9707 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4841 0.8347 -1.3801 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3313 0.0734 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0055 0.3338 0.5745 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8997 -0.0828 -0.3219 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4736 0.1256 0.2702 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -0.6123 1.5264 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0873 -0.3576 2.0621 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1911 -0.7979 1.1624 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9073 -1.4636 0.1411 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5423 -0.4895 1.4275 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8806 0.3025 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9785 -0.5418 3.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6489 -1.1434 2.0385 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7929 -0.7233 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9254 -1.6756 -0.2577 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1273 -1.8543 -0.7055 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9832 -2.4284 -0.8968 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3884 1.5613 -3.6954 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 2.2464 -2.3801 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6889 0.5193 -2.3795 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3694 -0.0039 -4.2618 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3767 1.6895 -4.8152 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2350 0.9670 -3.9935 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 2.3767 -3.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6241 0.7211 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8711 -0.5571 -2.2256 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7098 0.4259 -2.0856 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4049 1.9155 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1881 0.2976 0.6091 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4159 -1.0171 -0.3684 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 1.4523 0.7327 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -0.0833 1.5972 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9038 0.5535 -1.2477 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -1.1325 -0.6588 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6086 1.2205 0.4144 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1911 -0.1762 -0.5051 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6363 -1.7257 1.3766 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0246 -0.4032 2.3291 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2192 0.7303 2.3008 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2506 -0.8693 3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 0.3738 3.3292 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2225 1.2860 2.2741 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6634 0.0431 3.8816 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4603 -1.3267 3.8574 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5959 -2.2461 2.0977 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6759 -0.7579 1.9283 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2024 0.2978 0.4994 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6982 -2.1277 -1.8289 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 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 18 14 1 0 1 22 1 0 1 23 1 0 1 24 1 0 2 25 1 0 2 26 1 0 3 27 1 0 3 28 1 0 4 29 1 0 4 30 1 0 5 31 1 0 5 32 1 0 6 33 1 0 6 34 1 0 7 35 1 0 7 36 1 0 8 37 1 0 8 38 1 0 9 39 1 0 9 40 1 0 10 41 1 0 10 42 1 0 11 43 1 0 11 44 1 0 15 45 1 0 15 46 1 0 16 47 1 0 16 48 1 0 17 49 1 0 17 50 1 0 18 51 1 0 21 52 1 0 M END