(Hydroxy(oxido)phosphoryl) phosphate
Basic information
- CAS
42499-21-8- Standard SMILES
O=P([O-])([O-])OP(=O)([O-])O- InChIKey
XPPKVPWEQAFLFU-UHFFFAOYSA-K- Molecular formula
- HO7P2-3
- Average molar mass
- 174.95 g/mol
- Monoisotopic mass
- 174.91975136
Overview
Diphosphate(3-) is a trivalent inorganic anion obtained by removal of all three protons from diphosphoric acid. It has a role as a Saccharomyces cerevisiae metabolite and a human metabolite. It is a diphosphate ion and a trivalent inorganic anion. It is a conjugate base of a diphosphate(2-). It is a conjugate acid of a diphosphate(4-).
Names & identifiers
- Preferred name
- (Hydroxy(oxido)phosphoryl) phosphate
- IUPAC
- [hydroxy(oxido)phosphoryl] phosphate
Names & synonyms
[hydroxy(oxido)phosphoryl] phosphate42499-21-8DTXSID60399285(Hydroxy(oxido)phosphoryl) phosphateRefChem:1050971DTXCID50350143hydrogen diphosphatediphosphate(3-)HP2O7(3-)Diphosphate (HP2O73-)CHEBI:33019a pyrophosphate group
Show more names
diphosphate(3-) anionBDBM50079022Q27115222
Database identifiers
- CAS
42499-21-8- PubChem CID
- 4097574
- DTXSID
DTXSID60399285- ChEBI
CHEBI:33019- Nikkaji
- J2.496.781F
Properties
Computed structural properties
- XLogP
- -3.4
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- -3
- Complexity
- 154
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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