Molecule ID: 1015

IUPAC Name: 2-aminoethyl dihydrogen phosphate

Description: The molecule is the ethanolamine mono-ester of phosphoric acid, and a metabolite of phospholipid metabolism. This phosphomonoester shows strong structural similarity to the inhibitory neurotransmitter GABA, and is decreased in post-mortem Alzheimer's disease brain. It has a role as a human metabolite, an algal metabolite and a mouse metabolite. It is a phosphoethanolamine and a primary amino compound. It is a conjugate acid of an O-phosphonatoethanaminium(1-).

SMILES: NCCOP(=O)(O)O

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

InChI: InChI=1S/C2H8NO4P/c3-1-2-7-8(4,5)6/h1-3H2,(H2,4,5,6)

Molecular Properties:
- Polar Surface Area: 92.8 Ų
- LogP: -4.8