Molecule ID: 126456477

IUPAC Name: (2R)-2-hydroxy-2-(phosphonomethyl)butanedioic acid

Description: The molecule is a dicarboxylic acid that is succinic acid in which the methylene hydrogens at position 2 have been replaced by phosphonomethyl and hydroxy groups (the R-enantiomer). It is a dicarboxylic acid, a hydroxy carboxylic acid, a tertiary alcohol and a member of phosphonic acids. It derives from a succinic acid. It is a conjugate acid of a (R)-2-(phosphonomethyl)malate(3-).

SMILES: O=C(O)C[C@](O)(CP(=O)(O)O)C(=O)O

SELFIES: [O][=C][Branch1][C][O][C][C@][Branch1][C][O][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C5H9O8P/c6-3(7)1-5(10,4(8)9)2-14(11,12)13/h10H,1-2H2,(H,6,7)(H,8,9)(H2,11,12,13)/t5-/m0/s1

Molecular Properties:
- Polar Surface Area: 152.0 Ų
- LogP: -3.3