Metabolite Selenophosphate
- Name
- Selenophosphate
- Description
- Not Available
- Structure
Structure for Selenophosphate
- Synonyms
- Not Available
- UNII
- Not Available
- CAS number
- Not Available
- Weight
- Average: 159.95
Monoisotopic: 160.89067727 - Chemical Formula
- H2O3PSe
- InChI Key
- JRPHGDYSKGJTKZ-UHFFFAOYSA-M
- InChI
- InChI=1S/H3O3PSe/c1-4(2,3)5/h(H3,1,2,3,5)/p-1
- IUPAC Name
- dihydroxy(selanylidene)-lambda5-phosphanolate
- SMILES
- OP(O)([O-])=[Se]
- Reactions
- Spectra
- Not Available
- Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 105.53102 predictedDeepCCS 1.0 (2019) [M+H]+ 108.4088 predictedDeepCCS 1.0 (2019) [M+Na]+ 117.16791 predictedDeepCCS 1.0 (2019) - External Links
- Human Metabolome Database
- HMDB0006407
- ChemSpider
- 7822178
- Predicted Properties
Property Value Source logP -1.1 Chemaxon pKa (Strongest Acidic) -6.3 Chemaxon Physiological Charge -3 Chemaxon Hydrogen Acceptor Count 4 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 63.52 Å2 Chemaxon Rotatable Bond Count 0 Chemaxon Refractivity 25.2 m3·mol-1 Chemaxon Polarizability 6.87 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon