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3-Phosphoglycerate

HCID 724
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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
820-11-1
Standard SMILES
O=C(O)C(O)COP(=O)(O)O
InChIKey
OSJPPGNTCRNQQC-UHFFFAOYSA-N
Molecular formula
C3H7O7P
Average molar mass
186.06 g/mol
Monoisotopic mass
185.99293956

Overview

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-).

Names & identifiers

Preferred name
3-Phosphoglycerate
IUPAC
2-hydroxy-3-phosphonooxypropanoic acid
English name
2-hydroxy-3-phosphonooxy-propanoic acid
Molecular formula
C3H7O7P
Molecular weight
186.06

Names & synonyms

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
Show more names
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

Database identifiers

CAS
820-11-1
PubChem CID
724
DTXSID
DTXSID601002368
ChEMBL
CHEMBL1160563、CHEMBL87788
ChEBI
CHEBI:17050
Nikkaji
J7.119F

Properties

Computed structural properties

XLogP
-2.6
Topological polar surface area
124 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
11
Formal charge
0
Complexity
182

Experimental & physicochemical properties

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)]

Physicochemical properties

Boiling point
536.6 · 536.6±60.0 °C(Predicted)
Density
1.936 · 1.936±0.06 g/cm3(Predicted)
pka
1.8 · 1.80±0.10(Predicted)
form
Solid
color
Pale purple to light pink

Chemistry & industry

Pharmacology

Tissue LocationsPlacenta
Cellular LocationsCytoplasm
Metabolite Pathways3-Phosphoglycerate dehydrogenase deficiency

Applications

Uses3-Phosphoglyceric acid is a metabolic intermediate in both glycolysis and the Calvin cycle. 3-Phosphoglyceric acid is involved in alveolar macrophage epigenetic regulation.

Suppliers14 total

陕西科贝莱药物研发有限公司13119135307 13119135307 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
陕西萃康医药科技有限公司+86-13119157289; +86-13119157289 · [email protected]
上海超岚化工科技中心(原上海巢莱)0-2022843681 15618226720 · [email protected]
南通全益生物科技有限公司+86-0513; 18051384581 · [email protected]
广州佳途科技股份有限公司020-81960175-877 18933936954 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
Yiwu Fengjin Commercial Company+86-19518257926 +86-19164429943 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]

Additional notes

DefinitionChEBI: A monophosphoglyceric acid having the phospho group at the 3-position. It is an intermediate in metabolic pathways like glycolysis and calvin cycle.

Related reactions

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Compound notes

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