Molecule ID: 6336010

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

Description: The molecule is a 2-hydroxydicarboxylic acid that is malic acid carrying an additional phosphinomethyl substituent at position 2. It has a role as a bacterial metabolite. It is a 2-hydroxydicarboxylic acid and a member of phosphinic acids. It derives from a malic acid. It is a conjugate acid of a 2-phosphinomethylmalate(3-).

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

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

InChI: InChI=1S/C5H7O7P/c6-3(7)1-5(10,4(8)9)2-13(11)12/h10H,1-2H2,(H2-,6,7,8,9,11,12)/p+1

Molecular Properties:
- Polar Surface Area: 132.0 Ų
- LogP: -2.6