HMDB0006078 RDKit 3D Putreanine 28 27 0 0 0 0 0 0 0 0999 V2000 4.7413 0.6404 0.3108 N 0 0 0 0 0 4 0 0 0 0 0 0 3.6620 -0.0374 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3382 0.4581 0.1712 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1753 -0.2361 -0.5247 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0993 0.3191 0.0704 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2752 -0.2925 -0.5167 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4391 0.3648 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6759 -0.3282 -0.4461 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8467 0.3362 0.1522 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4437 1.2356 -0.4814 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2807 -0.0225 1.4008 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6645 0.3528 -0.1142 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 1.6764 0.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 0.3640 1.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7961 -1.1258 -0.2224 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6661 0.2559 -1.4485 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2792 0.2983 1.2776 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2163 1.5422 0.0079 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1963 -0.0499 -1.6092 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2771 -1.3236 -0.3392 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1721 1.4044 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0974 0.0483 1.1353 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3053 -0.1811 -1.5544 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4028 1.4308 -0.1892 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4023 0.3095 1.1954 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7359 -0.2769 -1.5447 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5787 -1.3947 -0.1117 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6595 -0.3276 2.1588 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 2 0 9 11 1 0 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 4 19 1 0 4 20 1 0 5 21 1 0 5 22 1 0 6 23 1 0 7 24 1 0 7 25 1 0 8 26 1 0 8 27 1 0 11 28 1 0 M CHG 1 1 1 M END