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3'-Methoxydaidzein , CAS No.21913-98-4

COA COA
In stock
Item Number
M646336
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M646336-1mg
1mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$180.90
M646336-5mg
5mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$450.90
M646336-10mg
10mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$720.90
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Flavonoids Isoflavones

View related series
Flavonoids Isoflavones (5) Ion channel (2197) Membrane Transporter/Ion Channel (1822) Sodium Channel (211)

Basic Description

Synonyms B0005-220938 | DTXSID30176328 | 3'-Methoxydaidzein | Q27134268 | SCHEMBL2069826 | CS-0017701 | 7-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one | LMPK12050057 | CHEBI:65780 | HY-N1847 | 7,4'-dihydroxy-3'-methoxyisoflavone | 7-hydroxy-3-(4-hydroxy-
Biochemical and Physiological Mechanisms 3'-Methoxydaidzein is a isoflavone and a Sodium Channel inhibitor. 3'-Methoxydaidzein inhibits subtypes NaV1.7, NaV1.8 and NaV1.3 with IC 50 of 181 nM, 397 nM, and 505 nM, respectively. 3'-Methoxydaidzein exerts analgesic activity by inhibiting voltage-ga
Storage Temp Store at -20°C
Shipped In
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This product requires cold chain shipping. Ground and other economy services are not available.
Product Description

3'-Methoxydaidzein is a isoflavone and a Sodium Channel inhibitor. 3'-Methoxydaidzein inhibits subtypes NaV1.7, NaV1.8 and NaV1.3 with IC 50 of 181 nM, 397 nM, and 505 nM, respectively. 3'-Methoxydaidzein exerts analgesic activity by inhibiting voltage-gated sodium channels

IC50& Target:Nav1.3 505 nM (IC 50 ) Nav1.7 181 nM (IC 50 ) Nav1.8 397 nM (IC 50 )

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Phenylpropanoids and polyketides
Class Isoflavonoids
Subclass O-methylated isoflavonoids
Intermediate Tree Nodes 3'-O-methylated isoflavonoids
Direct Parent 3'-O-methylisoflavones
Alternative Parents Isoflavones  Hydroxyisoflavonoids  Chromones  Methoxyphenols  Phenoxy compounds  Methoxybenzenes  Anisoles  Pyranones and derivatives  Alkyl aryl ethers  1-hydroxy-2-unsubstituted benzenoids  Heteroaromatic compounds  Oxacyclic compounds  Organic oxides  Hydrocarbon derivatives  
Molecular Framework Aromatic heteropolycyclic compounds
Substituents 3p-methoxyisoflavone - Hydroxyisoflavonoid - Isoflavone - Chromone - Benzopyran - Methoxyphenol - 1-benzopyran - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Pyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Organoheterocyclic compound - Oxacycle - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description This compound belongs to the class of organic compounds known as 3'-o-methylisoflavones. These are flavones with methoxy groups attached to the C2' atom of the isoflavone backbone.
External Descriptors Isoflavonoids

Associated Targets(Human)

MCF7 (126967 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
T47D (39041 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Plasmodium falciparum (966862 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
BV-2 (3710 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

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 7-hydroxy-3-(4-hydroxy-3-methoxyphenyl)chromen-4-one
INCHI InChI=1S/C16H12O5/c1-20-15-6-9(2-5-13(15)18)12-8-21-14-7-10(17)3-4-11(14)16(12)19/h2-8,17-18H,1H3
InChIKey MUYAUELJBWQNDH-UHFFFAOYSA-N
Smiles COC1=C(C=CC(=C1)C2=COC3=C(C2=O)C=CC(=C3)O)O
Isomeric SMILES COC1=C(C=CC(=C1)C2=COC3=C(C2=O)C=CC(=C3)O)O
PubChem CID 5319422
Molecular Weight 284.26

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

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

Chemical and Physical Properties

Molecular Weight 284.260 g/mol
XLogP3 2.400
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 284.068 Da
Monoisotopic Mass 284.068 Da
Topological Polar Surface Area 76.000 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 432.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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