Molecule ID: 6998947

IUPAC Name: (3S)-3-azaniumylpropane-1,1,3-tricarboxylate

Description: The molecule is a tricarboxylic acid dianion that is obtained from gamma-carboxy-L-glutamic acid by removal of a proton from each of the carboxy groups and protonation of the amino group; the resulting entity has an overall charge of 2-. It is an ammonium ion derivative and a tricarboxylic acid dianion. It is a conjugate base of a gamma-carboxy-L-glutamic acid zwitterion. It is a conjugate acid of a gamma-carboxy-L-glutamate(3-).

SMILES: N[C@@H](CC(C(=O)[O-])C(=O)[O-])C(=O)O

SELFIES: [N][C@@H1][Branch1][#C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O-1][C][=Branch1][C][=O][O-1][C][=Branch1][C][=O][O]

InChI: InChI=1S/C6H9NO6/c7-3(6(12)13)1-2(4(8)9)5(10)11/h2-3H,1,7H2,(H,8,9)(H,10,11)(H,12,13)/p-2/t3-/m0/s1

Molecular Properties:
- Polar Surface Area: 148.0 Ų
- LogP: -1.8