HMDB0013159 RDKit 3D 2,3-Diaminosalicylic acid 20 20 0 0 0 0 0 0 0 0999 V2000 -2.8461 -0.5223 -0.4487 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 0.1242 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4558 1.4908 -0.3279 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2395 2.0934 -0.1419 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9267 1.3372 0.1291 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1124 1.9573 0.3082 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7906 -0.0208 0.1979 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -0.9110 0.4705 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7199 -2.1729 0.5213 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2185 -0.5205 0.6874 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4825 -0.6048 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5964 -2.0128 0.0762 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7252 -0.2743 0.0557 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9096 -1.3090 -1.1385 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 2.0893 -0.5357 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0923 3.1693 -0.1889 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0125 1.6362 0.4992 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8685 -0.5259 -0.0952 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8554 -2.4577 0.9667 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4144 -2.5655 -0.7742 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 5 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 7 11 2 0 11 12 1 0 11 2 1 0 1 13 1 0 1 14 1 0 3 15 1 0 4 16 1 0 6 17 1 0 10 18 1 0 12 19 1 0 12 20 1 0 M END