Molecule ID: 122357

IUPAC Name: [(2R,3R)-2,3-dihydroxy-4-oxobutyl] dihydrogen phosphate

Description: The molecule is an erythrose phosphate that is D-erythrose carrying a phosphate group at position 4. It is an intermediate in the pentose phosphate pathway and Calvin cycle. It has a role as a human metabolite, an Escherichia coli metabolite and a mouse metabolite. It derives from a D-erythrose. It is a conjugate acid of a D-erythrose 4-phosphate(2-).

SMILES: O=C[C@H](O)[C@H](O)COP(=O)(O)O

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

InChI: InChI=1S/C4H9O7P/c5-1-3(6)4(7)2-11-12(8,9)10/h1,3-4,6-7H,2H2,(H2,8,9,10)/t3-,4+/m0/s1

Molecular Properties:
- Polar Surface Area: 124.0 Ų
- LogP: -3.3