HMDB0012882 RDKit 3D Adipate semialdehyde 19 18 0 0 0 0 0 0 0 0999 V2000 2.4547 -1.2209 0.8971 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4083 -0.3644 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2867 -0.2646 -0.9171 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4633 0.9851 -0.6433 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0604 0.9561 0.7506 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9169 -0.2331 1.0521 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1289 -0.3077 0.2054 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4151 0.5533 -0.6557 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9705 -1.3940 0.3966 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2229 0.3515 -0.0282 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6496 -1.1603 -0.7802 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7253 -0.2401 -1.9391 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2997 1.1164 -1.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1524 1.8555 -0.7312 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6243 1.8813 0.9902 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 0.9149 1.4406 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2954 -0.0937 2.1091 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3989 -1.2022 0.9865 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0572 -2.1332 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 7 9 1 0 2 10 1 0 3 11 1 0 3 12 1 0 4 13 1 0 4 14 1 0 5 15 1 0 5 16 1 0 6 17 1 0 6 18 1 0 9 19 1 0 M END