Demethylwedelolactone - Moligand™,≥99% , CAS No.6468-55-9

CAS: 6468-55-9 Cat. No.: D647982 Peso molecular: 300.23 PubChem CID: 5489605
Disponible para pedir
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
Synonyms
MS-24319 | A867843 | Norwedelolactone | AKOS015897135 | CHEBI:191036 | SCHEMBL3364302 | HY-N2028 | 1,3,8,9-TETRAHYDROXY-6H-BENZOFURO(3,2-C)(1)BENZOPYRAN-6-ONE | DTXSID00214968 | UXN2KXV8BB | 1,3,8,9-Tetrahydroxycoumestan | ZB1880 | desmethylwedelolactone
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1mg
D647982-1mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

29,90US$

44,90US$
Guardar 15,00 US$ (33.41%)
5mg
D647982-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

111,90US$

167,90US$
Guardar 56,00 US$ (33.35%)
10mg
D647982-10mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

199,90US$

299,90US$
Guardar 100,00 US$ (33.34%)
25mg
D647982-25mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
296,90US$
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Why this grade

Moligand™,≥99% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Descripción general

Demethylwedelolactone is a naturally occurring coumestan isolated from Eclipta alba . Demethylwedelolactone is a potent trypsin inhibitor with an IC 50 of 3.0 μM. Demethylwedelolactone suppresses cell motility and cell invasion of breast cancer cell

Specifications

Sinónimos
MS-24319 | A867843 | Norwedelolactone | AKOS015897135 | CHEBI:191036 | SCHEMBL3364302 | HY-N2028 | 1, 3, 8, 9-TETRAHYDROXY-6H-BENZOFURO(3, 2-C)(1)BENZOPYRAN-6-ONE | DTXSID00214968 | UXN2KXV8BB | 1, 3, 8, 9-Tetrahydroxycoumestan | ZB1880 | desmethylwedelolactone
Especificaciones y pureza
Moligand™, ≥99%
Mecanismos bioquímicos y fisiológicos
Demethylwedelolactone is a coumestan extracted from Eclipta alba that exhibits numerous biological activities including anti-inflammatory and hepato-protective. Demethylwedelolactone inhibits MDA-MB-231 breast cancer cells motility and invasiveness. It su
Condiciones de almacenamiento de almacenamiento
Store at -20°C
Enviado en
Ice chest + Ice pads
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Grado
Moligand™
Pureza
≥99%
Nombres e identificadores
Sonrisas canónicasC1=C(C=C2C(=C1O)C3=C(C4=CC(=C(C=C4O3)O)O)C(=O)O2)O
IUPAC Name1,3,8,9-tetrahydroxy-[1]benzofuro[3,2-c]chromen-6-one
InChIKeyLUTYTNLPIUCKBJ-UHFFFAOYSA-N
INCHI1S/C15H8O7/c16-5-1-9(19)13-11(2-5)22-15(20)12-6-3-7(17)8(18)4-10(6)21-14(12)13/h1-4,16-19H
Isómeros SMILES C1=C(C=C2C(=C1O)C3=C(C4=CC(=C(C=C4O3)O)O)C(=O)O2)O
PubChem CID 5489605
Peso molecular 300.23

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassPhenylpropanoids and polyketides
ClaseIsoflavonoids
SubclassCoumestans
Intermediate Tree Nodes Not available
Direct ParentCoumestans
Alternative Parents Angular furanocoumarins  1-benzopyrans  Furopyrans  Benzofurans  Pyranones and derivatives  1-hydroxy-4-unsubstituted benzenoids  1-hydroxy-2-unsubstituted benzenoids  Heteroaromatic compounds  Furans  Lactones  Polyols  Oxacyclic compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Coumestan - Furanocoumarin - Angular furanocoumarin - Coumarin - 1-benzopyran - Benzopyran - Benzofuran - Furopyran - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Benzenoid - Pyran - Furan - Heteroaromatic compound - Lactone - Oxacycle - Organoheterocyclic compound - Polyol - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as coumestans. These are polycyclic aromatic compounds containing a coumestan moiety, which consists of a benzoxole fused to a chromen-2-one to form 1-Benzoxolo[3,2-c]chromen-6-one. They are oxidation products of pterocarpan.
External Descriptors Coumestan flavonoids
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
PTK2 Tclin Focal adhesion kinase 1 (4730 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NFKBIA Tchem NF-kappaB inhibitor alpha (187 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SK-HEP1 (1155 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MDA-MB-231 (73002 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Mmp2 Matrix metalloproteinase-2 (12 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mmp9 Matrix metalloproteinase 9 (38 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot NumberCertificate TypeFechaArticulo
L2518324Certificate of AnalysisOct 28, 2025 D647982
L2518325Certificate of AnalysisOct 28, 2025 D647982
L2518326Certificate of AnalysisOct 28, 2025 D647982
L2518327Certificate of AnalysisOct 28, 2025 D647982
Propiedades químicas y físicas
SensibilidadMoisture sensitive
Peso molecular300.220 g/mol
XLogP32.100
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count0
Exact Mass300.027 Da
Monoisotopic Mass300.027 Da
Topological Polar Surface Area120.000 Ų
Heavy Atom Count22
Formal Charge0
Complexity469.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
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