HMDB0257294 RDKit 3D Rolipram 41 43 0 0 0 0 0 0 0 0999 V2000 -1.3193 -4.0100 -1.1323 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -2.6523 -0.8908 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4379 -1.8165 -0.5735 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8308 -2.3932 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9193 -1.6236 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7659 -0.2758 0.0487 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9608 0.5182 0.3788 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0749 0.3566 -0.6348 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2581 0.6202 0.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0367 0.4107 1.4138 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9524 0.5669 2.4551 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6216 -0.0401 1.6277 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4929 0.2858 -0.0265 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6152 -0.4691 -0.3356 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8723 0.0451 -0.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 1.3457 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 1.4089 0.8306 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6854 1.6965 0.1349 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2224 2.5536 -1.0479 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0256 1.7670 -1.5177 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2445 -4.4564 -1.5627 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5239 -4.1375 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0056 -4.5512 -0.2044 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9772 -3.4465 -0.6869 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9011 -2.1177 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7232 1.5810 0.5601 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1203 -0.6889 -0.9415 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9694 1.0734 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9015 0.8746 2.2453 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1924 0.3442 2.5568 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 -1.1570 1.5742 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3594 1.3464 0.1618 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5339 2.0812 0.0452 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4719 0.4416 1.3919 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 2.2228 1.5705 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4094 2.2606 0.7365 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1731 0.7820 -0.2753 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9457 3.5617 -0.7215 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9790 2.5324 -1.8586 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3673 2.3125 -2.1955 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4285 0.8464 -2.0276 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 6 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 14 3 1 0 20 16 1 0 12 7 1 0 1 21 1 0 1 22 1 0 1 23 1 0 4 24 1 0 5 25 1 0 7 26 1 0 8 27 1 0 8 28 1 0 11 29 1 0 12 30 1 0 12 31 1 0 13 32 1 0 16 33 1 0 17 34 1 0 17 35 1 0 18 36 1 0 18 37 1 0 19 38 1 0 19 39 1 0 20 40 1 0 20 41 1 0 M END