Grundinformationen
- Standard-SMILES
O=C(CO)[C@@H](O)[C@H](O)[C@H](O)COP(=O)(O)O- InChIKey
GSXOAOHZAIYLCY-HSUXUTPPSA-N- Summenformel
- C6H13O9P
- Durchschnittliche Molmasse
- 260,14 g/mol
- Monoisotopische Masse
- 260,02971899
Namen und Bezeichner
- Bevorzugter Name
- Fructose 6-phosphate
- IUPAC
- [(2R,3R,4S)-2,3,4,6-tetrahydroxy-5-oxohexyl] dihydrogen phosphate
- Lokaler Name
- D-Fructose-6-(dihydrogenphosphat)
- Englischer Name
- D-fructose 6-(dihydrogen phosphate)
- Summenformel
- C6H13O9P
- Molmasse
- 260.14
Namen und Synonyme
fructose-6-phosphateFructose 6-Phosphate643-13-06814-87-52012QM764Y[(2R,3R,4S)-2,3,4,6-tetrahydroxy-5-oxohexyl] dihydrogen phosphate{[(2R,3R,4S)-2,3,4,6-tetrahydroxy-5-oxohexyl]oxy}phosphonic acid(((2R,3R,4S)-2,3,4,6-tetrahydroxy-5-oxohexyl)oxy)phosphonic acid((2R,3R,4S)-2,3,4,6-tetrahydroxy-5-oxohexyl) dihydrogen phosphateRefChem:600597GlyTouCan:G12594GBCHEBI:88003
Weitere Namen anzeigen
F6Pfruc6pFru6-PlactacidogenA-D-fructose-6-PMethotrexate Impurity 23
G12594GB211-395-6Neuberg esterD-fructose-6-phosphateD-fructose 6-(dihydrogen phosphate)fructose-6Pfructose-6-PD-fructose-6-P
Datenbank-Bezeichner
- CAS
643-13-0、6814-87-5- PubChem CID
- 69507
- DTXSID
DTXSID80904350- ChEBI
CHEBI:15946- UNII
- 2012QM764Y
- EC Number
- 211-395-6
- Nikkaji
- J92.807K
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -4,3
- Polarare Oberfläche (TPSA)
- 165 Ų
- H-Brücken-Donoren
- 6
- H-Brücken-Akzeptoren
- 9
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 16
- Formalladung
- 0
- Komplexität
- 273
Experimentelle und physikochemische Eigenschaften
Solubility911 mg/mL
Physical Description
Very soluble in water; [Merck Index]
Solid
Collision Cross Section
150 Ų [M+Na]+ [CCS Type: TW; Method: calibrated with polyalanine]
154.2 Ų [M+Na]+ [CCS Type: DT; Method: single field calibrated with Agilent tune mix (Agilent)]
156.44 Ų [M+Na]+ [CCS Type: DT; Method: stepped-field]；148.02 Ų [M-H]- [CCS Type: DT; Method: stepped-field]
154.4 Ų [M+Na]+ [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]；144.1 Ų [M-H]- [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]；154.9 Ų [M+Na-2H]- [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]
146.1 Ų [M-H]-；154.8 Ų [M-2H+Na]-；154.3 Ų [M+Na]+；155.2 Ų [M+Na]+；144.3 Ų [M-H]-
Physikochemische Eigenschaften
- Siedepunkt
- 697.7 · 697.7±65.0 °C(Predicted)
- Dichte
- 1.84 · 1.840±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, sealed storage, away from moisture
- Aggregatzustand
- Solid
- pka
- 1.83 · 1.83±0.10(Predicted)
- Farbe
- White to off-white
- EPA chemische Informationen
- 6 · D-Fructose, 6-(dihydrogen phosphate) (643-13-0)
Sicherheit und Regulatorisches
Sicherheitsdaten
- tsca
- TSCA listed
- ridadr
- 1759
- hazard_class
- 8
- packing_group
- III
Chemie und Industrie
Pharmakologische Informationen
Tissue LocationsIntestine；Prostate
Cellular LocationsCytoplasm
Metabolite Pathways
2-Hydroxyglutric Aciduria (D And L Form)；4-Hydroxybutyric Aciduria/Succinic Semialdehyde Dehydrogenase Deficiency；Amino Sugar Metabolism；Fanconi-bickel syndrome；Fructose and mannose metabolism；Fructose intolerance, hereditary；Fructose-1,6-diphosphatase deficiency；Fructosuria；G(M2)-Gangliosidosis: Variant B, Tay-sachs disease；Glucose-6-phosphate dehydrogenase deficiency；Total 30 pathways, visit the HMDB page for details
Verwendung und Herstellung
UsesPresent in animal tissues as an equilibrium mixture with glucose-6-phosphate. [Merck Index]
General Manufacturing InformationD-Fructose, 6-(dihydrogen phosphate): INACTIVE
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