3-Phosphoglycerate
Grundinformationen
- CAS
820-11-1- Standard-SMILES
O=C(O)C(O)COP(=O)(O)O- InChIKey
OSJPPGNTCRNQQC-UHFFFAOYSA-N- Summenformel
- C3H7O7P
- Durchschnittliche Molmasse
- 186,06 g/mol
- Monoisotopische Masse
- 185,99293956
Überblick
3-phosphoglyceric acid is a monophosphoglyceric acid having the phospho group at the 3-position. It is an intermediate in metabolic pathways like glycolysis and calvin cycle. It has a role as a fundamental metabolite and an algal metabolite. It is a monophosphoglyceric acid and a tetronic acid derivative. It is functionally related to a glyceric acid. It is a conjugate acid of a 3-phosphoglycerate, a 3-phosphoglycerate(3-) and a 3-phosphoglycerate(2-).
Namen und Bezeichner
- Bevorzugter Name
- 3-Phosphoglycerate
- IUPAC
- 2-hydroxy-3-phosphonooxypropanoic acid
- Englischer Name
- 2-hydroxy-3-phosphonooxy-propanoic acid
- Summenformel
- C3H7O7P
- Molmasse
- 186.06
Namen und Synonyme
3-phosphoglycerateglycerate 3-phosphateRefChem:505004GlyTouCan:G50853HECHEBI:132960G50853HE820-11-13-phosphoglyceric acid2-hydroxy-3-phosphonooxypropanoic acid2-hydroxy-3-(phosphonooxy)propanoic acidGlyceric acid 3-phosphate3-Glycerophosphoric acid
Weitere Namen anzeigen
β-Phosphate glyceric acid2-hydroxy-3-phosphonooxy-propanoic acid3-(Phosphonooxy)-2-hydroxypropanoic acid2-Hydroxy-3-(phosphonooxy)propionic acidPropanoic acid, 2-hydroxy-3-(phosphonooxy)-3Phosphoglyceric acid,3 Phosphoglyceric acid2-Hydroxy-3-(dihydroxyphosphinyloxy)propionic acid
CHEMBL87788CHEBI:170503-(dihydrogen phosphate)Glycerate3-(dihydrogen phosphate)Glyceric acidD-(-)-3-Phosphoglyceric acidGlyceric acid-3-phosphate3-P-D-glycerateGlycerol Impurity 11
Datenbank-Bezeichner
- CAS
820-11-1
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -2,6
- Polarare Oberfläche (TPSA)
- 124 Ų
- H-Brücken-Donoren
- 4
- H-Brücken-Akzeptoren
- 7
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 182
Experimentelle und physikochemische Eigenschaften
Chemical ClassesOther Classes -> Organophosphates, Other
Physical DescriptionSolid
Collision Cross Section136.1 Ų [M+H]+ [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]
Physikochemische Eigenschaften
- Siedepunkt
- 536.6 · 536.6±60.0 °C(Predicted)
- Dichte
- 1.936 · 1.936±0.06 g/cm3(Predicted)
- pka
- 1.8 · 1.80±0.10(Predicted)
- Aggregatzustand
- Solid
- Farbe
- Pale purple to light pink
Chemie und Industrie
Pharmakologische Informationen
Tissue LocationsPlacenta
Cellular LocationsCytoplasm
Metabolite Pathways3-Phosphoglycerate dehydrogenase deficiency
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