Molecule ID: 15458487

IUPAC Name: (2S)-2-amino-3-(3-phosphonoimidazol-4-yl)propanoic acid

Description: The molecule is a histidine derivative in which L-histidine has been phosphorylated on the pros N atom. It is a non-proteinogenic L-alpha-amino acid and a L-histidine derivative.

SMILES: N[C@@H](Cc1cncn1P(=O)(O)O)C(=O)O

SELFIES: [N][C@@H1][Branch1][P][C][C][=C][N][=C][N][Ring1][Branch1][P][=Branch1][C][=O][Branch1][C][O][O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C6H10N3O5P/c7-5(6(10)11)1-4-2-8-3-9(4)15(12,13)14/h2-3,5H,1,7H2,(H,10,11)(H2,12,13,14)/t5-/m0/s1

Molecular Properties:
- Polar Surface Area: 139.0 Ų
- LogP: -4.8