Molecule ID: 119058140

IUPAC Name: (2,3-dicarboxy-3-hydroxypropyl)-hydroxy-oxophosphanium

Description: The molecule is a 2-hydroxydicarboxylic acid that is 2-hydroxy-3-methylbutanedioic acid in which one of the methyl hydrogens is replaced by a phosphino group It has a role as a bacterial metabolite. It is a 2-hydroxydicarboxylic acid and a member of phosphinic acids. It is a conjugate acid of a phosphinomethylisomalate(3-).

SMILES: O=C(O)C(O)C(C[P+](=O)O)C(=O)O

SELFIES: [O][=C][Branch1][C][O][C][Branch1][C][O][C][Branch1][#Branch1][C][P+1][=Branch1][C][=O][O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C5H7O7P/c6-3(5(9)10)2(4(7)8)1-13(11)12/h2-3,6H,1H2,(H2-,7,8,9,10,11,12)/p+1

Molecular Properties:
- Polar Surface Area: 132.0 Ų
- LogP: -2.3