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Hydroxyphenyllactic acid

CAT: 0804-HY-113219-02Size: 10 mM - 1 mLDry Ice: NoHazardous: No
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CAT#:0804-HY-113219-02Size:10 mM - 1 mL
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Description
Hydroxyphenyllactic acid is an antifungal metabolite.
CAS Number
306-23-0
Product Name Alternative
3M-852A
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Endogenous Metabolite; Fungal
Type
Natural Products
Related Pathways
Anti-infection; Metabolic Enzyme/Protease
Applications
COVID-19-immunoregulation
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/Hydroxyphenyllactic_acid.html
Concentration
10mM
Purity
99.95
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
O=C(O)C(O)CC1=CC=C(O)C=C1
Molecular Formula
C9H10O4
Molecular Weight
182.17
Precautions
H302, H315, H319, H335
References & Citations
[1]Mu W, et al. Production of 4-hydroxyphenyllactic acid by Lactobacillus sp. SK007 fermentation. J Biosci Bioeng. 2010 Apr;109 (4) :369-71.
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; Microbial Metabolite

Chemical Information

(+-)-3-(4-Hydroxyphenyl)lactic acid

3-(4-hydroxyphenyl)lactic acid is a 2-hydroxy carboxylic acid that is lactic acid in which one of the methyl hydrogens is substituted by a 4-hydroxyphenyl group. It has a role as a bacterial metabolite and a human metabolite. It is a member of phenols and a 2-hydroxy carboxylic acid. It is functionally related to a rac-lactic acid. It is a conjugate acid of a 3-(4-hydroxyphenyl)lactate.

CAS Number306-23-0
PubChem CID9378
IUPAC Name2-hydroxy-3-(4-hydroxyphenyl)propanoic acid
Molecular FormulaC9H10O4
Molecular Weight182.17
XLogP0.3
Topological Polar Surface Area77.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity172
SMILES
C1=CC(=CC=C1CC(C(=O)O)O)O
InChI
InChI=1S/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13)
InChIKey
JVGVDSSUAVXRDY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (+-)-3-(4-Hydroxyphenyl)lactic acid
CAS: 306-23-0
CID: 9378
Formula: C9H10O4
MW: 182.17
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight182.17
XLogP30.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass182.05790880
Monoisotopic Mass182.05790880
Topological Polar Surface Area77.8 Ų
Heavy Atom Count13
Formal Charge0
Complexity172
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes