(±)-Sodium 3-hydroxybutyrate - ≥98% , CAS No.150-83-4

CAS: 150-83-4 Cat. No.: X131756 Formula: CH₃CH(OH)CH₂COONa Peso molecolare: 126.09 Beilstein Registry Number: 4824866 Numero EC: 205-774-5

GRADE & PURITY ≥98%

Synonyms

C4H7NaO3 | H-4001 | DL-beta-Hydroxybutyric acid sodium salt | H-4000 | SODIUM 3-HYDROXYBUTYRATE, DL- | sodium;3-hydroxybutanoate | DL-3-HYDROXYBUTYRICACIDSODIUMSALT | Sodium DL-beta-hydroxybutyrate | .BETA.-HYDROXYBUTYRIC ACID SODIUM SALT | beta-Hydroxybu

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinonimi

C4H7NaO3 | H-4001 | DL-beta-Hydroxybutyric acid sodium salt | H-4000 | SODIUM 3-HYDROXYBUTYRATE, DL- | sodium;3-hydroxybutanoate | DL-3-HYDROXYBUTYRICACIDSODIUMSALT | Sodium DL-beta-hydroxybutyrate | .BETA.-HYDROXYBUTYRIC ACID SODIUM SALT | beta-Hydroxybu

Specifiche e purezza

≥98%

Meccanismi biochimici e fisiologici

β-Hydroxybutyric acid is a ketone body present in the rumen epithelium of liver cells. Its interconversion to acetoacetate influences the acid-base balance and is coupled NADH generation from (nicotinamide adenine dinucleotide) NAD+, measured fluorimetric

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥98%

Product Line

X131756-5g

Nomi e identificatori

Pubchem Sid

508809079

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508809079

Sorrisi canonici

CC(CC(=O)[O-])O.[Na+]

IUPAC Name

sodium;3-hydroxybutanoate

InChIKey

NBPUSGBJDWCHKC-UHFFFAOYSA-M

INCHI

1S/C4H8O3.Na/c1-3(5)2-4(6)7;/h3,5H,2H2,1H3,(H,6,7);/q;+1/p-1

Isomeri SMILES

CC(CC(=O)[O-])O.[Na+]

WGK Germania

3

CAS alternativo

306-31-0

Peso molecolare

126.09

Beilstein

4824866

Reaxy-Rn

4824866

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4824866&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Hydroxy acids and derivatives
      • Subclass Beta hydroxy acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Hydroxy acids and derivatives
• Subclass: Beta hydroxy acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Beta hydroxy acids and derivatives
• Alternative Parents: Short-chain hydroxy acids and derivatives Fatty acids and conjugates Secondary alcohols Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Beta-hydroxy acid - Short-chain hydroxy acid - Fatty acid - Carboxylic acid salt - Secondary alcohol - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic alkali metal salt - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organic oxide - Organooxygen compound - Alcohol - Carbonyl group - Organic oxygen compound - Organic sodium salt - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as beta hydroxy acids and derivatives. These are compounds containing a carboxylic acid substituted with a hydroxyl group on the C3 carbon atom.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Obiettivi associati (umani)

HEK293 (82097 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

FFAR3 Tchem Free fatty acid receptor 3 (304 Activities)

Discover Target: FFAR3

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: Moisture sensitive
• Punto di fusione (°C): 167-170°C
• Peso molecolare: 126.090 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 126.029 Da
• Monoisotopic Mass: 126.029 Da
• Topological Polar Surface Area: 60.400 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 73.700
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3