HMDB0040340 RDKit 3D 2-Isopropyl-3-methoxypyrazine 23 23 0 0 0 0 0 0 0 0999 V2000 1.8408 -2.1629 0.6474 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7239 -1.3591 0.3334 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8853 -0.0204 0.0588 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1179 0.5581 0.0921 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3244 1.8587 -0.1827 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2401 2.6412 -0.5248 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0468 2.0637 -0.5528 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2033 0.7662 -0.2757 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5531 0.1699 -0.1714 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8883 -0.7257 -1.3183 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0508 -0.1578 1.1774 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9098 -3.0101 -0.1157 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7694 -1.5449 0.4592 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8881 -2.5227 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3402 2.2823 -0.1283 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 3.6716 -0.7443 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2321 1.1210 -0.4613 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8245 -1.2602 -1.0487 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0854 -1.5128 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0088 -0.2361 -2.2751 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8098 0.6200 1.5552 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6033 -1.1102 1.2657 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2791 -0.1297 2.0019 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 2 0 8 9 1 0 9 10 1 0 9 11 1 0 8 3 1 0 1 12 1 0 1 13 1 0 1 14 1 0 5 15 1 0 6 16 1 0 9 17 1 0 10 18 1 0 10 19 1 0 10 20 1 0 11 21 1 0 11 22 1 0 11 23 1 0 M END