Marvin 01130615152D 9 8 0 0 1 0 999 V2000 1.0451 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0451 0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7596 -0.1105 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3307 -0.1105 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3307 -0.9355 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3838 0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0983 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0983 -0.9355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8128 0.3020 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 2 1 0 0 0 0 4 2 1 0 0 0 0 4 5 1 0 0 0 0 6 4 1 0 0 0 0 7 6 1 0 0 0 0 8 7 2 0 0 0 0 9 7 1 0 0 0 0 M CHG 3 3 -1 5 1 9 -1 M END > CHEBI:35391 > aspartate(1-) > An α-amino-acid anion that is the conjugate base of aspartic acid. > 3 > CHEBI:22659; CHEBI:29992 > aspartic acid monoanion; aspartate(1-); 2-ammoniosuccinate; 2-ammoniobutanedioate > hydrogen aspartate > C4H6NO4 > 132.09478 > 132.03023 > -1 > [NH3+]C(CC([O-])=O)C([O-])=O > InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1 > CKLJMWTZIZZHCS-UHFFFAOYSA-M $$$$