Molecule ID: 6451998

IUPAC Name: [(3R,4S,5S)-3,4,5-trihydroxy-2-oxohexyl] dihydrogen phosphate

Description: The molecule is a deoxyketohexose phosphate consisting of L-rhamnulose having a monophosphate group at the 1-position. It has a role as an Escherichia coli metabolite. It derives from a L-rhamnulose. It is a conjugate acid of a L-rhamnulose 1-phosphate(2-).

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

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

InChI: InChI=1S/C6H13O8P/c1-3(7)5(9)6(10)4(8)2-14-15(11,12)13/h3,5-7,9-10H,2H2,1H3,(H2,11,12,13)/t3-,5-,6-/m0/s1

Molecular Properties:
- Polar Surface Area: 145.0 Ų
- LogP: -3.3