Molecule ID: 15983958

IUPAC Name: [3-methylbut-2-enoxy(oxido)phosphoryl] phosphate

Description: The molecule is trianion of prenyl diphosphate arising from deprotonation of the three diphosphate OH groups. It has a role as an epitope, a phosphoantigen, a human metabolite and a Saccharomyces cerevisiae metabolite. It is a conjugate base of a prenyl diphosphate.

SMILES: CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]

SELFIES: [C][C][Branch1][C][C][=C][C][O][P][=Branch1][C][=O][Branch1][C][O-1][O][P][=Branch1][C][=O][Branch1][C][O-1][O-1]

InChI: InChI=1S/C5H12O7P2/c1-5(2)3-4-11-14(9,10)12-13(6,7)8/h3H,4H2,1-2H3,(H,9,10)(H2,6,7,8)/p-3

Molecular Properties:
- Polar Surface Area: 122.0 Ų
- LogP: -1.4