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

CAS: 6468-55-9 Cat. No.: D647982 分子式: C15H8O7 分子量: 300.23 PubChem CID: 5489605
注文可能
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
★
Size
USA
ドイツ (EU)*
Price
Qty
1mg
D647982-1mg
3 在庫あり
—

$29.90

$44.90
保存 $15.00 (33.41%)
5mg
D647982-5mg
3 在庫あり
—

$111.90

$167.90
保存 $56.00 (33.35%)
10mg
D647982-10mg
3 在庫あり
—

$199.90

$299.90
保存 $100.00 (33.34%)
25mg
D647982-25mg
4 在庫あり
—
$296.90
Enter a quantity for the sizes you want to add.
🧪
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.

📋

Quality documents

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

📚

Literature proof

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

概要

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

同義語
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
仕様と純度
Moligand™,≥99%
生化学的・生理学的メカニズム
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
保管条件
Store at -20°C
入荷
Ice chest + Ice pads
この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。
等級
Moligand™
純度
≥99%
名前と識別子
パブケム・シド
カノニカル・スマイル
C1=C(C=C2C(=C1O)C3=C(C4=CC(=C(C=C4O3)O)O)C(=O)O2)O
IUPAC Name
1,3,8,9-tetrahydroxy-[1]benzofuro[3,2-c]chromen-6-one
InChIKey
LUTYTNLPIUCKBJ-UHFFFAOYSA-N
INCHI
1S/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
異性体SMILES
C1=C(C=C2C(=C1O)C3=C(C4=CC(=C(C=C4O3)O)O)C(=O)O2)O
PubChem CID
5489605
分子量
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
分類Isoflavonoids
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
説明This 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
3 D構造
インタラクティブ化学構造モデル





関連ターゲット(人間)
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
関連ターゲット(非人間)
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
作用メカニズム
証明書(CoA、COO、BSE/TSEと分析図)
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 Type日付商品
L2518324Certificate of AnalysisOct 28, 2025 D647982
L2518325Certificate of AnalysisOct 28, 2025 D647982
L2518326Certificate of AnalysisOct 28, 2025 D647982
L2518327Certificate of AnalysisOct 28, 2025 D647982
化学的性質と物理的性質
感度Moisture sensitive
分子量300.220 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
ソリューション計算機
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