HMDB0254239 RDKit 3D 4-[(S)-Amino(carboxy)methyl]-3-methylbenzoic acid 26 26 0 0 0 0 0 0 0 0999 V2000 -0.2013 1.1631 1.9965 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2745 0.4330 0.8202 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5987 0.6987 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1736 0.0308 -0.6283 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5346 0.2611 -1.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0164 -0.3622 -2.0371 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3402 1.2105 -0.4396 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4158 -0.9095 -1.2872 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1327 -1.1608 -0.8982 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4946 -0.5012 0.1699 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9126 -0.8077 0.4591 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3755 -1.7743 -0.5293 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8497 0.3168 0.4329 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9277 1.2713 1.2191 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8298 0.3883 -0.6063 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7299 1.3294 2.6607 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5419 2.1899 1.8023 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8778 0.5708 2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1861 1.4328 0.9408 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0453 2.1805 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -1.4608 -2.1413 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4286 -1.9174 -1.4517 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9631 -1.3456 1.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3463 -1.3089 -1.4524 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9822 -2.7051 -0.4497 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5826 0.7766 -1.5040 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 1 0 5 6 2 0 5 7 1 0 4 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 2 0 13 15 1 0 10 2 1 0 1 16 1 0 1 17 1 0 1 18 1 0 3 19 1 0 7 20 1 0 8 21 1 0 9 22 1 0 11 23 1 0 12 24 1 0 12 25 1 0 15 26 1 0 M END