Molecule ID: 213144

IUPAC Name: (3R)-3-butanoyloxy-4-(trimethylazaniumyl)butanoate

Description: The molecule is an optically active form of O-butanoylcarnitine having L-configuration. It has a role as a metabolite. It is an O-butanoylcarnitine and a saturated fatty acyl-L-carnitine.

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

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

InChI: InChI=1S/C11H21NO4/c1-5-6-11(15)16-9(7-10(13)14)8-12(2,3)4/h9H,5-8H2,1-4H3/t9-/m1/s1

Molecular Properties:
- Polar Surface Area: 66.4 Ų
- LogP: 1.2