Molecule ID: 572

IUPAC Name: 3-[formyl(hydroxy)amino]propylphosphonic acid

Description: The molecule is propylphosphonic acid in which one of the hydrogens at position 3 is substituted by a formyl(hydroxy)amino group. An antibiotic obtained from Streptomyces lavendulae, it specifically inhibits DXP reductoisomerase (EC 1.1.1.267), a key enzyme in the non-mevalonate pathway of isoprenoid biosynthesis. It has a role as an antimicrobial agent, an EC 1.1.1.267 (1-deoxy-D-xylulose-5-phosphate reductoisomerase) inhibitor and a bacterial metabolite. It is a member of phosphonic acids and a hydroxamic acid.

SMILES: O=CN(O)CCCP(=O)(O)O

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

InChI: InChI=1S/C4H10NO5P/c6-4-5(7)2-1-3-11(8,9)10/h4,7H,1-3H2,(H2,8,9,10)

Molecular Properties:
- Polar Surface Area: 98.1 Ų
- LogP: -2.2