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5-Hydroxyferulic acid - 99%, high purity , CAS No.1782-55-4

COA

Grade & Purity:

≥99%

Cas Number: 1782-55-4
Molecular Weight: 210.18
EC Number: 803-254-8
PubChem CID: 446834

In stock

Item Number

H649625

Grouped product items
SKU	Size	Availability	Price	Qty
H649625-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$420.90
H649625-10mg	10mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$680.90

Phenols Polyphenols Ketones, Aldehydes, Acids

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Acids (103) Aldehydes (60) Amino Acid/Protein Metabolism (1836) COMT (16) Metabolic Enzyme/Protease (4860) Metabolite (5307) Neuronal Signaling (3320) Phenols Polyphenols Ketones (7)

Basic Description

Synonyms	SR-01000597542-1 \| (2E)-3-(3,4-Dihydroxy-5-methoxyphenyl)-2-propenoic acid \| 3-(3,4-dihydroxy-5-methoxyphenyl)acrylic acid \| 3,4-Dihydroxy-5-methoxycinnamoic acid \| Cinnamic acid, 3,4-dihydroxy-5-methoxy- \| HY-133068 \| PD164672 \| Q1033729 \| (2E)-3-(3,4-di
Specifications & Purity	≥99%
Biochemical and Physiological Mechanisms	5-Hydroxyferulic acid is a hydroxycinnamic acid and is a metabolite of the phenylpropanoid pathway. 5-Hydroxyferulic acid is a precursor in the biosynthesis of sinapic acid and is also a COMT non-esterifed substrate.
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	5-Hydroxyferulic acid is a hydroxycinnamic acid and is a metabolite of the phenylpropanoid pathway. 5-Hydroxyferulic acid is a precursor in the biosynthesis of sinapic acid and is also a COMT non-esterifed substrate In Vitro The product of the alfalfa Caffeic acid/5-hydroxyferulic acid 3/5-O-methyltransferase (COMT) catalyzed methylation of 5-Hydroxyferulic acid is sinapic acid. 5-Hydroxyferulic acid O-methyltransferase activities (pkat mg-1 protein) in stem material from COMT downregulates transgenic alfalfa. MCE has not independently confirmed the accuracy of these methods. They are for reference only. Form:Solid IC50& Target:Human Endogenous Metabolite

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Phenylpropanoids and polyketides
  - Class Cinnamic acids and derivatives
    - Subclass Hydroxycinnamic acids and derivatives

Kingdom	Organic compounds
Superclass	Phenylpropanoids and polyketides
Class	Cinnamic acids and derivatives
Subclass	Hydroxycinnamic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Hydroxycinnamic acids
Alternative Parents	Coumaric acids and derivatives Cinnamic acids Methoxyphenols Styrenes Phenoxy compounds Methoxybenzenes Catechols Anisoles 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Cinnamic acid - Hydroxycinnamic acid - Coumaric acid or derivatives - Methoxyphenol - Phenoxy compound - Anisole - Methoxybenzene - Styrene - Phenol ether - Catechol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Ether - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as hydroxycinnamic acids. These are compounds containing an cinnamic acid where the benzene ring is hydroxylated.
External Descriptors	Coniferyl alcohol derivatives
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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	(E)-3-(3,4-dihydroxy-5-methoxyphenyl)prop-2-enoic acid
INCHI	InChI=1S/C10H10O5/c1-15-8-5-6(2-3-9(12)13)4-7(11)10(8)14/h2-5,11,14H,1H3,(H,12,13)/b3-2+
InChIKey	YFXWTVLDSKSYLW-NSCUHMNNSA-N
Smiles	COC1=CC(=CC(=C1O)O)C=CC(=O)O
Isomeric SMILES	COC1=CC(=CC(=C1O)O)/C=C/C(=O)O
Alternate CAS	1782-55-4,110642-42-7
PubChem CID	446834
MeSH Entry Terms	5-hydroxyferulic acid
Molecular Weight	210.18

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Solubility	DMSO : 100 mg/mL (475.78 mM; Need ultrasonic)
Molecular Weight	210.180 g/mol
XLogP3	1.100
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	210.053 Da
Monoisotopic Mass	210.053 Da
Topological Polar Surface Area	87.000 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	250.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	1
Covalently-Bonded Unit Count	1

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