HMDB0060287 RDKit 3D 4-Hydroperoxy-2-nonenal 28 27 0 0 0 0 0 0 0 0999 V2000 -3.7694 0.2407 0.8009 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4634 -0.5551 -0.4434 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0906 -0.2156 -0.9833 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9974 -0.5052 0.0056 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3184 -0.1378 -0.6184 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4854 -0.4049 0.3308 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7641 -0.0280 -0.3259 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3963 1.1163 -0.0286 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6446 1.4746 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2092 0.7613 -1.5373 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3145 0.2146 1.5492 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2379 -0.6450 2.5465 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0383 1.0531 0.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8088 0.6503 0.7854 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7308 -0.4372 1.7022 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5411 -1.6455 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 -0.2593 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9386 -0.8272 -1.8917 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1068 0.8525 -1.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1486 0.0589 0.9409 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0248 -1.5784 0.2621 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3513 0.9471 -0.8415 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5203 -0.6758 -1.5429 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5135 -1.5147 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2274 -0.6653 -1.0664 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9106 1.7281 0.7111 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1175 2.4045 -0.4056 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8536 -1.4071 2.4138 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 2 0 8 9 1 0 9 10 2 0 6 11 1 0 11 12 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 2 17 1 0 3 18 1 0 3 19 1 0 4 20 1 0 4 21 1 0 5 22 1 0 5 23 1 0 6 24 1 0 7 25 1 0 8 26 1 0 9 27 1 0 12 28 1 0 M END