Molecule ID: 25201132

IUPAC Name: 2-(methylazaniumyl)ethyl phosphate

Description: The molecule is conjugate base of N-methylethanolamine phosphate having an anionic phosphate group and a protonated amino group; major species at pH 7.3. It has a role as a human metabolite. It is a conjugate base of a N-methylethanolamine phosphate.

SMILES: CNCCOP(=O)([O-])O

SELFIES: [C][N][C][C][O][P][=Branch1][C][=O][Branch1][C][O-1][O]

InChI: InChI=1S/C3H10NO4P/c1-4-2-3-8-9(5,6)7/h4H,2-3H2,1H3,(H2,5,6,7)/p-1

Molecular Properties:
- Polar Surface Area: 89.0 Ų
- LogP: -4.4