3-Hydroxybutyric acid

CAT: 0804-HY-113378-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-113378-01Size:100 mg

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Description

3-Hydroxybutyric acid (β-Hydroxybutyric acid) is a metabolite that is elevated in type I diabetes. 3-Hydroxybutyric acid can modulate the properties of membrane lipids[1].

CAS Number

300-85-6

Product Name Alternative

β-Hydroxybutyric acid

UNSPSC

12352211

Hazard Statement

H302, H315, H319, H335

Target

Endogenous Metabolite

Type

Natural Products

Related Pathways

Metabolic Enzyme/Protease

Applications

Metabolism-sugar/lipid metabolism

Field of Research

Metabolic Disease

Assay Protocol

https://www.medchemexpress.com/3-Hydroxybutyric_acid.html

Concentration

10mM

Purity

99.79

Solubility

0.1 M NaOH : 100 mg/mL (ultrasonic; adjust pH to 6 with NaOH) |H2O : 50 mg/mL (ultrasonic)

Smiles

CC(O)CC(O)=O

Molecular Formula

C4H8O3

Molecular Weight

104.10

Precautions

H302, H315, H319, H335

References & Citations

[1]Hsu TT, et al. 3-Hydroxybutyric acid interacts with lipid monolayers at concentrations that impair consciousness. Langmuir. 2013 Feb 12;29 (6) :1948-55.

Shipping Conditions

Room Temperature

Storage Conditions

4°C (Powder, sealed storage, away from moisture)

Scientific Category

Natural Products

Clinical Information

No Development Reported

Isoform

Human Endogenous Metabolite

Citation 01

Chemical Information

3-Hydroxybutyric Acid

3-hydroxybutyric acid is a straight-chain 3-hydroxy monocarboxylic acid comprising a butyric acid core with a single hydroxy substituent in the 3- position; a ketone body whose levels are raised during ketosis, used as an energy source by the brain during fasting in humans. Also used to synthesise biodegradable plastics. It has a role as a human metabolite. It is a hydroxybutyric acid, a 3-hydroxy monocarboxylic acid and an (omega-1)-hydroxy fatty acid. It is functionally related to a butyric acid. It is a conjugate acid of a 3-hydroxybutyrate.

CAS Number	300-85-6
PubChem CID	441
IUPAC Name	3-hydroxybutanoic acid
Molecular Formula	C4H8O3
Molecular Weight	104.10
XLogP	-0.5
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	7
Formal Charge	0
Complexity	69

SMILES

CC(CC(=O)O)O

InChI

InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)

InChIKey

WHBMMWSBFZVSSR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 300-85-6

CID: 441

Formula: C4H8O3

MW: 104.10

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	104.10
XLogP3	-0.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	104.047344113
Monoisotopic Mass	104.047344113
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	69.3
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
sc-231749	3-Hydroxybutyric acid
GK7020-25mg	(R) -3-Hydroxybutyric acid
sc-236812	(S) -3-Hydroxybutyric acid
C07452-25mg	3-Hydroxybutyric acid (BHB)
T65133-01	3-Hydroxybutyric acid sodium
OR1025252	Poly (3-Hydroxybutyric Acid)
H10430-01	3-Hydroxybutyric acid 95%

3-Hydroxybutyric acid

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