Molecule ID: 11966294

IUPAC Name: [(1R,2R)-1-carboxy-2-methylbutyl]azanium

Description: The molecule is the D-enantiomer of isoleucinium. It has a role as a Saccharomyces cerevisiae metabolite and a bacterial metabolite. It is a conjugate acid of a D-isoleucine. It is an enantiomer of a L-isoleucinium.

SMILES: CC[C@@H](C)[C@@H]([NH3+])C(=O)O

SELFIES: [C][C][C@@H1][Branch1][C][C][C@@H1][Branch1][C][NH3+1][C][=Branch1][C][=O][O]

InChI: InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/p+1/t4-,5-/m1/s1

Molecular Properties:
- Polar Surface Area: 64.9 Ų
- LogP: -1.7