Molecule ID: 25246146

IUPAC Name: [2,3-dihydroxy-3-(1H-indol-3-yl)propyl] phosphate

Description: The molecule is an organophosphate oxoanion resulting the from removal of two protons from the phosphate group of 1-C-(indol-3-yl)glycerol 3-phosphate. It has a role as a Saccharomyces cerevisiae metabolite. It is a conjugate base of a 1-C-(indol-3-yl)glycerol 3-phosphate.

SMILES: O=P([O-])([O-])OCC(O)C(O)c1c[nH]c2ccccc12

SELFIES: [O][=P][Branch1][C][O-1][Branch1][C][O-1][O][C][C][Branch1][C][O][C][Branch1][C][O][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1]

InChI: InChI=1S/C11H14NO6P/c13-10(6-18-19(15,16)17)11(14)8-5-12-9-4-2-1-3-7(8)9/h1-5,10-14H,6H2,(H2,15,16,17)/p-2

Molecular Properties:
- Polar Surface Area: 129.0 Ų
- LogP: -1.4